N-(oxan-4-yl)pyrimidin-2-amine

N-(oxan-4-yl)pyrimidin-2-amine

CAS: 1153379-19-1

Formula: C9H13N3O

SMILES: C1CC(CCO1)NC1=NC=CC=N1

IUPAC: N-(oxan-4-yl)pyrimidin-2-amine

InChI: InChI=1S/C9H13N3O/c1-4-10-9(11-5-1)12-8-2-6-13-7-3-8/h1,4-5,8H,2-3,6-7H2,(H,10,11,12)

Composition: C (60.32%), H (7.31%), N (23.45%), O (8.93%)

Molar Mass: 179.223

Atom Count: 26

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	179.105862051
Formal Charge	0
FSP3	0.56
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	MPHWXORUAMKZIT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.34
Topological Polar Surface Area	47.04
Polarizability	18.86
Ring Count	2
Rotatable Bond Count	2

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