N-cyclopentyl-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride

C15H18ClN3O2 — CID 3079300

IUPACN-cyclopentyl-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride
SMILESCc1cccc2ncc(C(=O)NC3CCCC3)c(=O)n12.Cl
InChIInChI=1S/C15H17N3O2.ClH/c1-10-5-4-8-13-16-9-12(15(20)18(10)13)14(19)17-11-6-2-3-7-11;/h4-5,8-9,11H,2-3,6-7H2,1H3,(H,17,19);1H
InChIKeyIHGFYUJTULSIIW-UHFFFAOYSA-N
MW307.78 g/mol
LogP2.10
Rot. Bonds2

About N-cyclopentyl-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride

N-cyclopentyl-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride (PubChem CID 3079300) has the molecular formula C15H18ClN3O2 and a molecular weight of 307.78 g/mol. Its IUPAC name is N-cyclopentyl-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-cyclopentyl-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride
PubChem CID3079300
Molecular FormulaC15H18ClN3O2
Molecular Weight307.78 g/mol
Exact Mass307.11
IUPAC NameN-cyclopentyl-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride
SMILESCc1cccc2ncc(C(=O)NC3CCCC3)c(=O)n12.Cl
InChIInChI=1S/C15H17N3O2.ClH/c1-10-5-4-8-13-16-9-12(15(20)18(10)13)14(19)17-11-6-2-3-7-11;/h4-5,8-9,11H,2-3,6-7H2,1H3,(H,17,19);1H
InChIKeyIHGFYUJTULSIIW-UHFFFAOYSA-N
XLogP2.10
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.78
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride?
The IUPAC name of N-cyclopentyl-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride (CID 3079300) is N-cyclopentyl-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-cyclopentyl-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-cyclopentyl-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride is Cc1cccc2ncc(C(=O)NC3CCCC3)c(=O)n12.Cl.
What is the InChIKey of N-cyclopentyl-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride?
The InChIKey is IHGFYUJTULSIIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2.ClH/c1-10-5-4-8-13-16-9-12(15(20)18(10)13)14(19)17-11-6-2-3-7-11;/h4-5,8-9,11H,2-3,6-7H2,1H3,(H,17,19);1H.
What are the key properties of N-cyclopentyl-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride?
N-cyclopentyl-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride has a molecular weight of 307.78 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 3079300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).