N-(2-ethylpentyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-4-carboxamide

C15H24N4O — CID 143544161

IUPACN-(2-ethylpentyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-4-carboxamide
SMILESCCCC(CC)CNC(=O)c1ncnc2c1CCNC2
InChIInChI=1S/C15H24N4O/c1-3-5-11(4-2)8-17-15(20)14-12-6-7-16-9-13(12)18-10-19-14/h10-11,16H,3-9H2,1-2H3,(H,17,20)
InChIKeyHVBFEPWXBVXRFI-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.68
Rot. Bonds6

About N-(2-ethylpentyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-4-carboxamide

N-(2-ethylpentyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-4-carboxamide (PubChem CID 143544161) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(2-ethylpentyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-ethylpentyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-4-carboxamide
PubChem CID143544161
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC NameN-(2-ethylpentyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-4-carboxamide
SMILESCCCC(CC)CNC(=O)c1ncnc2c1CCNC2
InChIInChI=1S/C15H24N4O/c1-3-5-11(4-2)8-17-15(20)14-12-6-7-16-9-13(12)18-10-19-14/h10-11,16H,3-9H2,1-2H3,(H,17,20)
InChIKeyHVBFEPWXBVXRFI-UHFFFAOYSA-N
XLogP1.68
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-ethylpentyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2R)-2-ethylpentyl]benzamide
CID 2334822
N-[(2R)-2-ethylhexyl]-1H-1,2,4-triazole-5-carboxamide
CID 2174349
N-(2-ethylpentyl)-3,5-difluoro-4-hydroxybenzamide
CID 171503801
N-[2-(2-hydroxyethyl)pentyl]-2,3-dihydro-1H-isoindole-5-carboxamide
CID 104873176
methyl 2-(1-ethoxybutyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-4-carboxylate
CID 114741842
2-(1-methoxybutyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-4-carboxylic acid
CID 114743065
N-(2-ethylbutyl)-1H-1,2,4-triazole-5-carboxamide
CID 115749130
N-(2-ethylhexyl)-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 107815415
2-(2-ethylhexylcarbamoyl)pyridine-3-carboxylic acid
CID 63614926
N-[2-(2-hydroxyethyl)pentyl]pyridine-4-carboxamide
CID 111662354
3-bromo-N-[2-(2-hydroxyethyl)pentyl]pyridine-2-carboxamide
CID 114078844
3-amino-N-[2-(2-hydroxyethyl)pentyl]pyridine-2-carboxamide
CID 114145530

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylpentyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-4-carboxamide?
The IUPAC name of N-(2-ethylpentyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-4-carboxamide (CID 143544161) is N-(2-ethylpentyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-4-carboxamide.
What is the SMILES notation for N-(2-ethylpentyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-4-carboxamide?
The canonical SMILES for N-(2-ethylpentyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-4-carboxamide is CCCC(CC)CNC(=O)c1ncnc2c1CCNC2.
What is the InChIKey of N-(2-ethylpentyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-4-carboxamide?
The InChIKey is HVBFEPWXBVXRFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-3-5-11(4-2)8-17-15(20)14-12-6-7-16-9-13(12)18-10-19-14/h10-11,16H,3-9H2,1-2H3,(H,17,20).
What are the key properties of N-(2-ethylpentyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-4-carboxamide?
N-(2-ethylpentyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-4-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.68, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylpentyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-4-carboxamide is sourced from PubChem (CID 143544161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).