4-amino-1-(cyclopropylmethyl)pyridin-2-one;hydrochloride

C9H13ClN2O — CID 155822557

IUPAC4-amino-1-(cyclopropylmethyl)pyridin-2-one;hydrochloride
SMILESCl.Nc1ccn(CC2CC2)c(=O)c1
InChIInChI=1S/C9H12N2O.ClH/c10-8-3-4-11(9(12)5-8)6-7-1-2-7;/h3-5,7H,1-2,6,10H2;1H
InChIKeyZXANMBVKMFEVDO-UHFFFAOYSA-N
MW200.67 g/mol
LogP1.26
Rot. Bonds2

About 4-amino-1-(cyclopropylmethyl)pyridin-2-one;hydrochloride

4-amino-1-(cyclopropylmethyl)pyridin-2-one;hydrochloride (PubChem CID 155822557) has the molecular formula C9H13ClN2O and a molecular weight of 200.67 g/mol. Its IUPAC name is 4-amino-1-(cyclopropylmethyl)pyridin-2-one;hydrochloride.

Molecular Properties

Compound Name4-amino-1-(cyclopropylmethyl)pyridin-2-one;hydrochloride
PubChem CID155822557
Molecular FormulaC9H13ClN2O
Molecular Weight200.67 g/mol
Exact Mass200.07
IUPAC Name4-amino-1-(cyclopropylmethyl)pyridin-2-one;hydrochloride
SMILESCl.Nc1ccn(CC2CC2)c(=O)c1
InChIInChI=1S/C9H12N2O.ClH/c10-8-3-4-11(9(12)5-8)6-7-1-2-7;/h3-5,7H,1-2,6,10H2;1H
InChIKeyZXANMBVKMFEVDO-UHFFFAOYSA-N
XLogP1.26
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.67
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-1-(cyclopropylmethyl)pyridin-2-one;hydrochloride?
The IUPAC name of 4-amino-1-(cyclopropylmethyl)pyridin-2-one;hydrochloride (CID 155822557) is 4-amino-1-(cyclopropylmethyl)pyridin-2-one;hydrochloride.
What is the SMILES notation for 4-amino-1-(cyclopropylmethyl)pyridin-2-one;hydrochloride?
The canonical SMILES for 4-amino-1-(cyclopropylmethyl)pyridin-2-one;hydrochloride is Cl.Nc1ccn(CC2CC2)c(=O)c1.
What is the InChIKey of 4-amino-1-(cyclopropylmethyl)pyridin-2-one;hydrochloride?
The InChIKey is ZXANMBVKMFEVDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O.ClH/c10-8-3-4-11(9(12)5-8)6-7-1-2-7;/h3-5,7H,1-2,6,10H2;1H.
What are the key properties of 4-amino-1-(cyclopropylmethyl)pyridin-2-one;hydrochloride?
4-amino-1-(cyclopropylmethyl)pyridin-2-one;hydrochloride has a molecular weight of 200.67 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-(cyclopropylmethyl)pyridin-2-one;hydrochloride is sourced from PubChem (CID 155822557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).