1-(pyridin-4-ylmethyl)-1,4-diazepane

1-(pyridin-4-ylmethyl)-1,4-diazepane

CAS: 199938-13-1

Formula: C11H17N3

SMILES: C(N1CCCNCC1)C1=CC=NC=C1

IUPAC: 1-[(pyridin-4-yl)methyl]-1,4-diazepane

InChI: InChI=1S/C11H17N3/c1-4-12-7-9-14(8-1)10-11-2-5-13-6-3-11/h2-3,5-6,12H,1,4,7-10H2

Composition: C (69.07%), H (8.96%), N (21.97%)

Molar Mass: 191.278

Atom Count: 31

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	191.142247559
Formal Charge	0
FSP3	0.55
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	BSSOBVDBEBZUJL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.06
Topological Polar Surface Area	28.16
Polarizability	22.82
Ring Count	2
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	199938-13-1		$344.00-$438.00$344.00$438.00