N-(6-piperidin-1-ylpyrimidin-4-yl)cyclopentanecarboxamide

C15H22N4O — CID 90544433

IUPACN-(6-piperidin-1-ylpyrimidin-4-yl)cyclopentanecarboxamide
SMILESO=C(Nc1cc(N2CCCCC2)ncn1)C1CCCC1
InChIInChI=1S/C15H22N4O/c20-15(12-6-2-3-7-12)18-13-10-14(17-11-16-13)19-8-4-1-5-9-19/h10-12H,1-9H2,(H,16,17,18,20)
InChIKeyJBLCBFBFFZWREY-UHFFFAOYSA-N
MW274.37 g/mol
LogP2.60
Rot. Bonds3

About N-(6-piperidin-1-ylpyrimidin-4-yl)cyclopentanecarboxamide

N-(6-piperidin-1-ylpyrimidin-4-yl)cyclopentanecarboxamide (PubChem CID 90544433) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is N-(6-piperidin-1-ylpyrimidin-4-yl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(6-piperidin-1-ylpyrimidin-4-yl)cyclopentanecarboxamide
PubChem CID90544433
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC NameN-(6-piperidin-1-ylpyrimidin-4-yl)cyclopentanecarboxamide
SMILESO=C(Nc1cc(N2CCCCC2)ncn1)C1CCCC1
InChIInChI=1S/C15H22N4O/c20-15(12-6-2-3-7-12)18-13-10-14(17-11-16-13)19-8-4-1-5-9-19/h10-12H,1-9H2,(H,16,17,18,20)
InChIKeyJBLCBFBFFZWREY-UHFFFAOYSA-N
XLogP2.60
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]cyclohexanecarboxamide
CID 90545334
1-(6-methylpyridazin-3-yl)-N-(6-piperidin-1-ylpyrimidin-4-yl)piperidine-4-carboxamide
CID 90544737
N-(6-piperidin-1-ylpyrimidin-4-yl)pyrimidine-2-carboxamide
CID 90544711
N-[2-[(6-pyrrolidin-1-ylpyrimidin-4-yl)amino]ethyl]cyclopropanecarboxamide
CID 122327457
trans-(1S,2S)-2-[(6-piperidin-1-ylpyrimidin-4-yl)amino]cyclohexan-1-ol
CID 133495426
1-phenyl-3-(6-piperidin-1-ylpyrimidin-4-yl)urea
CID 90544742
N-[6-(4-cyclopentylpiperazin-1-yl)pyrimidin-4-yl]pyrrolidine-1-carboxamide
CID 23652954
2-cyclohexyl-N-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]acetamide
CID 90543700
4-iodo-N-(6-piperidin-1-ylpyrimidin-4-yl)benzamide
CID 90544651
1-cyclohexyl-3-[6-(4-cyclopentylpiperazin-1-yl)pyrimidin-4-yl]urea
CID 23652956
N-(6-pyrrolidin-1-ylpyrimidin-4-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 90544921
1-[6-(ethylamino)pyrimidin-4-yl]-N-methylpiperidine-4-carboxamide
CID 80799616

Frequently Asked Questions

What is the IUPAC name of N-(6-piperidin-1-ylpyrimidin-4-yl)cyclopentanecarboxamide?
The IUPAC name of N-(6-piperidin-1-ylpyrimidin-4-yl)cyclopentanecarboxamide (CID 90544433) is N-(6-piperidin-1-ylpyrimidin-4-yl)cyclopentanecarboxamide.
What is the SMILES notation for N-(6-piperidin-1-ylpyrimidin-4-yl)cyclopentanecarboxamide?
The canonical SMILES for N-(6-piperidin-1-ylpyrimidin-4-yl)cyclopentanecarboxamide is O=C(Nc1cc(N2CCCCC2)ncn1)C1CCCC1.
What is the InChIKey of N-(6-piperidin-1-ylpyrimidin-4-yl)cyclopentanecarboxamide?
The InChIKey is JBLCBFBFFZWREY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c20-15(12-6-2-3-7-12)18-13-10-14(17-11-16-13)19-8-4-1-5-9-19/h10-12H,1-9H2,(H,16,17,18,20).
What are the key properties of N-(6-piperidin-1-ylpyrimidin-4-yl)cyclopentanecarboxamide?
N-(6-piperidin-1-ylpyrimidin-4-yl)cyclopentanecarboxamide has a molecular weight of 274.37 g/mol, XLogP of 2.60, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-piperidin-1-ylpyrimidin-4-yl)cyclopentanecarboxamide is sourced from PubChem (CID 90544433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).