N-cyclopentyl-6-(2-ethylpiperidin-1-yl)pyrimidine-4-carboxamide

C17H26N4O — CID 109341455

IUPACN-cyclopentyl-6-(2-ethylpiperidin-1-yl)pyrimidine-4-carboxamide
SMILESCCC1CCCCN1c1cc(C(=O)NC2CCCC2)ncn1
InChIInChI=1S/C17H26N4O/c1-2-14-9-5-6-10-21(14)16-11-15(18-12-19-16)17(22)20-13-7-3-4-8-13/h11-14H,2-10H2,1H3,(H,20,22)
InChIKeyAYTSFAPDVFKIDM-UHFFFAOYSA-N
MW302.42 g/mol
LogP2.92
Rot. Bonds4

About N-cyclopentyl-6-(2-ethylpiperidin-1-yl)pyrimidine-4-carboxamide

N-cyclopentyl-6-(2-ethylpiperidin-1-yl)pyrimidine-4-carboxamide (PubChem CID 109341455) has the molecular formula C17H26N4O and a molecular weight of 302.42 g/mol. Its IUPAC name is N-cyclopentyl-6-(2-ethylpiperidin-1-yl)pyrimidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-6-(2-ethylpiperidin-1-yl)pyrimidine-4-carboxamide
PubChem CID109341455
Molecular FormulaC17H26N4O
Molecular Weight302.42 g/mol
Exact Mass302.21
IUPAC NameN-cyclopentyl-6-(2-ethylpiperidin-1-yl)pyrimidine-4-carboxamide
SMILESCCC1CCCCN1c1cc(C(=O)NC2CCCC2)ncn1
InChIInChI=1S/C17H26N4O/c1-2-14-9-5-6-10-21(14)16-11-15(18-12-19-16)17(22)20-13-7-3-4-8-13/h11-14H,2-10H2,1H3,(H,20,22)
InChIKeyAYTSFAPDVFKIDM-UHFFFAOYSA-N
XLogP2.92
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(2-ethylpiperidin-1-yl)-N-prop-2-enylpyrimidine-4-carboxamide
CID 109339691
6-(2-ethylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)pyrimidine-4-carboxamide
CID 109344596
N-cyclohexyl-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide
CID 109274707
6-(2-ethylpiperidin-1-yl)-N-(2-methylphenyl)pyrimidine-4-carboxamide
CID 109354878
N-cyclohexyl-6-(2-ethylpiperidin-1-yl)pyrimidin-4-amine
CID 112856254
6-[(2S)-2-ethylpiperidin-1-yl]-N-methylpyrimidin-4-amine
CID 129372140
N-cyclopropyl-2-(2-ethylpiperidin-1-yl)pyrimidine-4-carboxamide
CID 109295796
6-(2-ethylazepan-1-yl)-N-methylpyrimidin-4-amine
CID 104693081
N-cyclopropyl-6-(4-ethylpiperazin-1-yl)pyrimidine-4-carboxamide
CID 109339234
N-cycloheptyl-2-(2-ethylpiperidin-1-yl)pyrimidine-5-carboxamide
CID 109263083
N-cyclopentyl-5-(2-ethylpiperidin-1-yl)pyridine-3-carboxamide
CID 109225954
4-N,6-N-dicyclohexylpyrimidine-4,6-dicarboxamide
CID 131994880

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-6-(2-ethylpiperidin-1-yl)pyrimidine-4-carboxamide?
The IUPAC name of N-cyclopentyl-6-(2-ethylpiperidin-1-yl)pyrimidine-4-carboxamide (CID 109341455) is N-cyclopentyl-6-(2-ethylpiperidin-1-yl)pyrimidine-4-carboxamide.
What is the SMILES notation for N-cyclopentyl-6-(2-ethylpiperidin-1-yl)pyrimidine-4-carboxamide?
The canonical SMILES for N-cyclopentyl-6-(2-ethylpiperidin-1-yl)pyrimidine-4-carboxamide is CCC1CCCCN1c1cc(C(=O)NC2CCCC2)ncn1.
What is the InChIKey of N-cyclopentyl-6-(2-ethylpiperidin-1-yl)pyrimidine-4-carboxamide?
The InChIKey is AYTSFAPDVFKIDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O/c1-2-14-9-5-6-10-21(14)16-11-15(18-12-19-16)17(22)20-13-7-3-4-8-13/h11-14H,2-10H2,1H3,(H,20,22).
What are the key properties of N-cyclopentyl-6-(2-ethylpiperidin-1-yl)pyrimidine-4-carboxamide?
N-cyclopentyl-6-(2-ethylpiperidin-1-yl)pyrimidine-4-carboxamide has a molecular weight of 302.42 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-6-(2-ethylpiperidin-1-yl)pyrimidine-4-carboxamide is sourced from PubChem (CID 109341455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).