N-cyclopentyl-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide

C16H24N4O — CID 109298035

IUPACN-cyclopentyl-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide
SMILESCC1CCN(c2nccc(C(=O)NC3CCCC3)n2)CC1
InChIInChI=1S/C16H24N4O/c1-12-7-10-20(11-8-12)16-17-9-6-14(19-16)15(21)18-13-4-2-3-5-13/h6,9,12-13H,2-5,7-8,10-11H2,1H3,(H,18,21)
InChIKeyURIFROQSJXIYQW-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.39
Rot. Bonds3

About N-cyclopentyl-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide

N-cyclopentyl-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide (PubChem CID 109298035) has the molecular formula C16H24N4O and a molecular weight of 288.39 g/mol. Its IUPAC name is N-cyclopentyl-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide
PubChem CID109298035
Molecular FormulaC16H24N4O
Molecular Weight288.39 g/mol
Exact Mass288.20
IUPAC NameN-cyclopentyl-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide
SMILESCC1CCN(c2nccc(C(=O)NC3CCCC3)n2)CC1
InChIInChI=1S/C16H24N4O/c1-12-7-10-20(11-8-12)16-17-9-6-14(19-16)15(21)18-13-4-2-3-5-13/h6,9,12-13H,2-5,7-8,10-11H2,1H3,(H,18,21)
InChIKeyURIFROQSJXIYQW-UHFFFAOYSA-N
XLogP2.39
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methylpiperidin-1-yl)-N-pentylpyrimidine-4-carboxamide
CID 109299018
N-[2-(dimethylamino)ethyl]-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide
CID 109298960
N-(3,5-dichlorophenyl)-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide
CID 109299118
N-(4-methoxyphenyl)-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide
CID 109299068
N-[(4-methylphenyl)methyl]-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide
CID 109298970
N-[(4-fluorophenyl)methyl]-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide
CID 109298973
N-cyclopropyl-2-(2-ethylpiperidin-1-yl)pyrimidine-4-carboxamide
CID 109295796
N-cycloheptyl-2-(4-methylpiperidin-1-yl)pyrimidine-5-carboxamide
CID 109250891
N-(2-cyanophenyl)-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide
CID 109299125
[2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-morpholin-4-ylmethanone
CID 109298958
2-pyrrolidin-1-yl-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrimidine-4-carboxamide
CID 95774218
N-(2-ethoxyphenyl)-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide
CID 109299069

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide?
The IUPAC name of N-cyclopentyl-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide (CID 109298035) is N-cyclopentyl-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide.
What is the SMILES notation for N-cyclopentyl-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide?
The canonical SMILES for N-cyclopentyl-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide is CC1CCN(c2nccc(C(=O)NC3CCCC3)n2)CC1.
What is the InChIKey of N-cyclopentyl-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide?
The InChIKey is URIFROQSJXIYQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O/c1-12-7-10-20(11-8-12)16-17-9-6-14(19-16)15(21)18-13-4-2-3-5-13/h6,9,12-13H,2-5,7-8,10-11H2,1H3,(H,18,21).
What are the key properties of N-cyclopentyl-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide?
N-cyclopentyl-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide has a molecular weight of 288.39 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide is sourced from PubChem (CID 109298035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).