4-methyl-2-(piperidin-1-yl)pyrimidine-5-carboxylic acid

4-methyl-2-(piperidin-1-yl)pyrimidine-5-carboxylic acid

CAS: 924872-01-5

Formula: C11H15N3O2

SMILES: CC1=C(C=NC(=N1)N1CCCCC1)C(O)=O

IUPAC: 4-methyl-2-(piperidin-1-yl)pyrimidine-5-carboxylic acid

InChI: InChI=1S/C11H15N3O2/c1-8-9(10(15)16)7-12-11(13-8)14-5-3-2-4-6-14/h7H,2-6H2,1H3,(H,15,16)

Composition: C (59.71%), H (6.83%), N (18.99%), O (14.46%)

Molar Mass: 221.26

Atom Count: 31

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	221.116426735
Formal Charge	0
FSP3	0.55
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	ZSUDXFSROAJWIJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	61.09
Topological Polar Surface Area	66.32
Polarizability	22.29
Ring Count	2
Rotatable Bond Count	2

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