N-(1-amino-2,3-dimethylbutan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide

C15H20N4O2 — CID 119608872

IUPACN-(1-amino-2,3-dimethylbutan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
SMILESCC(C)C(C)(CN)NC(=O)c1cnc2ccccn2c1=O
InChIInChI=1S/C15H20N4O2/c1-10(2)15(3,9-16)18-13(20)11-8-17-12-6-4-5-7-19(12)14(11)21/h4-8,10H,9,16H2,1-3H3,(H,18,20)
InChIKeyLKLRWIXVFHJOJS-UHFFFAOYSA-N
MW288.35 g/mol
LogP0.80
Rot. Bonds4

About N-(1-amino-2,3-dimethylbutan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide

N-(1-amino-2,3-dimethylbutan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide (PubChem CID 119608872) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is N-(1-amino-2,3-dimethylbutan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-(1-amino-2,3-dimethylbutan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
PubChem CID119608872
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC NameN-(1-amino-2,3-dimethylbutan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
SMILESCC(C)C(C)(CN)NC(=O)c1cnc2ccccn2c1=O
InChIInChI=1S/C15H20N4O2/c1-10(2)15(3,9-16)18-13(20)11-8-17-12-6-4-5-7-19(12)14(11)21/h4-8,10H,9,16H2,1-3H3,(H,18,20)
InChIKeyLKLRWIXVFHJOJS-UHFFFAOYSA-N
XLogP0.80
TPSA89.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-amino-2,3-dimethylbutan-2-yl)-7-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide;hydrochloride
CID 119605629
N-(2-methylpropoxy)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 115410125
N-(3-aminobutyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 119499484
N-(4-hydroxy-2,2-dimethylpentyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 111480033
(2S,3R)-3-hydroxy-2-[(4-oxopyrido[1,2-a]pyrimidine-3-carbonyl)amino]butanoic acid
CID 104964893
methyl (2R)-2-[(4-oxopyrido[1,2-a]pyrimidine-3-carbonyl)sulfamoyl]propanoate
CID 99802657
(2S)-2-hydroxy-3-[(4-oxopyrido[1,2-a]pyrimidine-3-carbonyl)amino]propanoic acid
CID 107833801
4-oxo-N-[2-(propan-2-ylcarbamoylamino)phenyl]pyrido[1,2-a]pyrimidine-3-carboxamide
CID 60555535
N-[2-(2-hydroxyethyl)-4-methylpentyl]-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 111662536
4-oxo-N-[(4-propan-2-yloxyphenyl)methyl]pyrido[1,2-a]pyrimidine-3-carboxamide
CID 134057826
N-(2,6-dimethylphenyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 4575304
N,N-bis(2-methylpropyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 71941067

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2,3-dimethylbutan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The IUPAC name of N-(1-amino-2,3-dimethylbutan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide (CID 119608872) is N-(1-amino-2,3-dimethylbutan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-(1-amino-2,3-dimethylbutan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-(1-amino-2,3-dimethylbutan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide is CC(C)C(C)(CN)NC(=O)c1cnc2ccccn2c1=O.
What is the InChIKey of N-(1-amino-2,3-dimethylbutan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The InChIKey is LKLRWIXVFHJOJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-10(2)15(3,9-16)18-13(20)11-8-17-12-6-4-5-7-19(12)14(11)21/h4-8,10H,9,16H2,1-3H3,(H,18,20).
What are the key properties of N-(1-amino-2,3-dimethylbutan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
N-(1-amino-2,3-dimethylbutan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 0.80, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2,3-dimethylbutan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 119608872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).