8-methyl-4-oxo-N-piperidin-4-yl-N-propylpyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride

C18H25ClN4O2 — CID 119823486

IUPAC8-methyl-4-oxo-N-piperidin-4-yl-N-propylpyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride
SMILESCCCN(C(=O)c1cnc2cc(C)ccn2c1=O)C1CCNCC1.Cl
InChIInChI=1S/C18H24N4O2.ClH/c1-3-9-21(14-4-7-19-8-5-14)17(23)15-12-20-16-11-13(2)6-10-22(16)18(15)24;/h6,10-12,14,19H,3-5,7-9H2,1-2H3;1H
InChIKeyPFNHCRLHKJMUPG-UHFFFAOYSA-N
MW364.88 g/mol
LogP2.03
Rot. Bonds4

About 8-methyl-4-oxo-N-piperidin-4-yl-N-propylpyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride

8-methyl-4-oxo-N-piperidin-4-yl-N-propylpyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride (PubChem CID 119823486) has the molecular formula C18H25ClN4O2 and a molecular weight of 364.88 g/mol. Its IUPAC name is 8-methyl-4-oxo-N-piperidin-4-yl-N-propylpyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound Name8-methyl-4-oxo-N-piperidin-4-yl-N-propylpyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride
PubChem CID119823486
Molecular FormulaC18H25ClN4O2
Molecular Weight364.88 g/mol
Exact Mass364.17
IUPAC Name8-methyl-4-oxo-N-piperidin-4-yl-N-propylpyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride
SMILESCCCN(C(=O)c1cnc2cc(C)ccn2c1=O)C1CCNCC1.Cl
InChIInChI=1S/C18H24N4O2.ClH/c1-3-9-21(14-4-7-19-8-5-14)17(23)15-12-20-16-11-13(2)6-10-22(16)18(15)24;/h6,10-12,14,19H,3-5,7-9H2,1-2H3;1H
InChIKeyPFNHCRLHKJMUPG-UHFFFAOYSA-N
XLogP2.03
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.88
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-4-oxo-N-piperidin-4-yl-N-propylpyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride?
The IUPAC name of 8-methyl-4-oxo-N-piperidin-4-yl-N-propylpyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride (CID 119823486) is 8-methyl-4-oxo-N-piperidin-4-yl-N-propylpyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride.
What is the SMILES notation for 8-methyl-4-oxo-N-piperidin-4-yl-N-propylpyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride?
The canonical SMILES for 8-methyl-4-oxo-N-piperidin-4-yl-N-propylpyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride is CCCN(C(=O)c1cnc2cc(C)ccn2c1=O)C1CCNCC1.Cl.
What is the InChIKey of 8-methyl-4-oxo-N-piperidin-4-yl-N-propylpyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride?
The InChIKey is PFNHCRLHKJMUPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2.ClH/c1-3-9-21(14-4-7-19-8-5-14)17(23)15-12-20-16-11-13(2)6-10-22(16)18(15)24;/h6,10-12,14,19H,3-5,7-9H2,1-2H3;1H.
What are the key properties of 8-methyl-4-oxo-N-piperidin-4-yl-N-propylpyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride?
8-methyl-4-oxo-N-piperidin-4-yl-N-propylpyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride has a molecular weight of 364.88 g/mol, XLogP of 2.03, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-4-oxo-N-piperidin-4-yl-N-propylpyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119823486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).