N-cyclopentyl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-5-carboxamide

C19H24N6O — CID 109249585

IUPACN-cyclopentyl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-5-carboxamide
SMILESO=C(NC1CCCC1)c1cnc(N2CCN(c3ccccn3)CC2)nc1
InChIInChI=1S/C19H24N6O/c26-18(23-16-5-1-2-6-16)15-13-21-19(22-14-15)25-11-9-24(10-12-25)17-7-3-4-8-20-17/h3-4,7-8,13-14,16H,1-2,5-6,9-12H2,(H,23,26)
InChIKeyPDJMFNLCYSBHDC-UHFFFAOYSA-N
MW352.44 g/mol
LogP1.87
Rot. Bonds4

About N-cyclopentyl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-5-carboxamide

N-cyclopentyl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-5-carboxamide (PubChem CID 109249585) has the molecular formula C19H24N6O and a molecular weight of 352.44 g/mol. Its IUPAC name is N-cyclopentyl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-5-carboxamide
PubChem CID109249585
Molecular FormulaC19H24N6O
Molecular Weight352.44 g/mol
Exact Mass352.20
IUPAC NameN-cyclopentyl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-5-carboxamide
SMILESO=C(NC1CCCC1)c1cnc(N2CCN(c3ccccn3)CC2)nc1
InChIInChI=1S/C19H24N6O/c26-18(23-16-5-1-2-6-16)15-13-21-19(22-14-15)25-11-9-24(10-12-25)17-7-3-4-8-20-17/h3-4,7-8,13-14,16H,1-2,5-6,9-12H2,(H,23,26)
InChIKeyPDJMFNLCYSBHDC-UHFFFAOYSA-N
XLogP1.87
TPSA74.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-cyclopentyl-2-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxamide
CID 109249567
N-cyclopentyl-2-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidine-5-carboxamide
CID 109249582
2-(4-benzylpiperidin-1-yl)-N-cyclopentylpyrimidine-5-carboxamide
CID 109249597
6-(dimethylamino)-N-(1-pyridin-2-ylpiperidin-4-yl)pyridine-3-carboxamide
CID 86989964
N-cycloheptyl-2-(4-methylpiperidin-1-yl)pyrimidine-5-carboxamide
CID 109250891
N-cyclopropyl-3-(4-pyridin-2-ylpiperazine-1-carbonyl)benzamide
CID 109050733
N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)pyrimidine-5-carboxamide
CID 109250307
6-(azetidin-1-yl)-N-[4-(pyridin-2-ylamino)cyclohexyl]pyridine-3-carboxamide
CID 136584132
(3-methylpiperidin-1-yl)-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]methanone
CID 109262221
(2-ethylpiperidin-1-yl)-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]methanone
CID 109262220
N-cyclohexyl-5-(4-pyrimidin-2-ylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109274695
N-cycloheptyl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
CID 4884816

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-5-carboxamide?
The IUPAC name of N-cyclopentyl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-5-carboxamide (CID 109249585) is N-cyclopentyl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-5-carboxamide.
What is the SMILES notation for N-cyclopentyl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-5-carboxamide?
The canonical SMILES for N-cyclopentyl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-5-carboxamide is O=C(NC1CCCC1)c1cnc(N2CCN(c3ccccn3)CC2)nc1.
What is the InChIKey of N-cyclopentyl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-5-carboxamide?
The InChIKey is PDJMFNLCYSBHDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N6O/c26-18(23-16-5-1-2-6-16)15-13-21-19(22-14-15)25-11-9-24(10-12-25)17-7-3-4-8-20-17/h3-4,7-8,13-14,16H,1-2,5-6,9-12H2,(H,23,26).
What are the key properties of N-cyclopentyl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-5-carboxamide?
N-cyclopentyl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-5-carboxamide has a molecular weight of 352.44 g/mol, XLogP of 1.87, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-5-carboxamide is sourced from PubChem (CID 109249585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).