N-cyclopropyl-1-(5-ethylpyrimidin-2-yl)piperidine-3-carboxamide

C15H22N4O — CID 166600796

IUPACN-cyclopropyl-1-(5-ethylpyrimidin-2-yl)piperidine-3-carboxamide
SMILESCCc1cnc(N2CCCC(C(=O)NC3CC3)C2)nc1
InChIInChI=1S/C15H22N4O/c1-2-11-8-16-15(17-9-11)19-7-3-4-12(10-19)14(20)18-13-5-6-13/h8-9,12-13H,2-7,10H2,1H3,(H,18,20)
InChIKeyGKGNRNNKEHGYIA-UHFFFAOYSA-N
MW274.37 g/mol
LogP1.53
Rot. Bonds4

About N-cyclopropyl-1-(5-ethylpyrimidin-2-yl)piperidine-3-carboxamide

N-cyclopropyl-1-(5-ethylpyrimidin-2-yl)piperidine-3-carboxamide (PubChem CID 166600796) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is N-cyclopropyl-1-(5-ethylpyrimidin-2-yl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-(5-ethylpyrimidin-2-yl)piperidine-3-carboxamide
PubChem CID166600796
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC NameN-cyclopropyl-1-(5-ethylpyrimidin-2-yl)piperidine-3-carboxamide
SMILESCCc1cnc(N2CCCC(C(=O)NC3CC3)C2)nc1
InChIInChI=1S/C15H22N4O/c1-2-11-8-16-15(17-9-11)19-7-3-4-12(10-19)14(20)18-13-5-6-13/h8-9,12-13H,2-7,10H2,1H3,(H,18,20)
InChIKeyGKGNRNNKEHGYIA-UHFFFAOYSA-N
XLogP1.53
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3R)-N-cyclopropyl-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 6557829
(3S)-N-cycloheptyl-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 1452540
1-[5-(ethylaminomethyl)pyrimidin-2-yl]-N-methylpiperidine-3-carboxamide
CID 103197016
1-(5-ethylpyrimidin-2-yl)-N-methylpiperidin-3-amine
CID 116976178
(3S)-1-[5-[(E)-2-(aminomethyl)-3-fluoroprop-2-enoxy]pyrimidin-2-yl]-N-cyclopropylpiperidine-3-carboxamide
CID 138612601
N-[1-(5-methoxypyrimidin-2-yl)piperidin-3-yl]cyclobutanecarboxamide
CID 171335318
N-[1-(5-bromopyrimidin-2-yl)piperidin-3-yl]cyclopropanecarboxamide
CID 155975360
tert-butyl N-[(E)-2-[[2-[3-(cyclopropylcarbamoyl)piperidin-1-yl]pyrimidin-5-yl]oxymethyl]-3-fluoroprop-2-enyl]carbamate
CID 166785695
N-cyclopropyl-1-quinoxalin-2-ylpiperidine-3-carboxamide
CID 49431443
3-[1-(5-ethylpyrimidin-2-yl)piperidin-3-yl]propanamide
CID 72927654
N-cyclohexyl-1-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-4-carboxamide
CID 53146198
N-[4-(2-methylbutan-2-yl)cyclohexyl]-1-pyrazin-2-ylpiperidine-3-carboxamide
CID 46597405

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(5-ethylpyrimidin-2-yl)piperidine-3-carboxamide?
The IUPAC name of N-cyclopropyl-1-(5-ethylpyrimidin-2-yl)piperidine-3-carboxamide (CID 166600796) is N-cyclopropyl-1-(5-ethylpyrimidin-2-yl)piperidine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-(5-ethylpyrimidin-2-yl)piperidine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-1-(5-ethylpyrimidin-2-yl)piperidine-3-carboxamide is CCc1cnc(N2CCCC(C(=O)NC3CC3)C2)nc1.
What is the InChIKey of N-cyclopropyl-1-(5-ethylpyrimidin-2-yl)piperidine-3-carboxamide?
The InChIKey is GKGNRNNKEHGYIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-2-11-8-16-15(17-9-11)19-7-3-4-12(10-19)14(20)18-13-5-6-13/h8-9,12-13H,2-7,10H2,1H3,(H,18,20).
What are the key properties of N-cyclopropyl-1-(5-ethylpyrimidin-2-yl)piperidine-3-carboxamide?
N-cyclopropyl-1-(5-ethylpyrimidin-2-yl)piperidine-3-carboxamide has a molecular weight of 274.37 g/mol, XLogP of 1.53, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(5-ethylpyrimidin-2-yl)piperidine-3-carboxamide is sourced from PubChem (CID 166600796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).