N-cyclohexyl-2-cyclopropyl-6-oxo-1H-pyrimidine-5-carboxamide

C14H19N3O2 — CID 166253059

IUPACN-cyclohexyl-2-cyclopropyl-6-oxo-1H-pyrimidine-5-carboxamide
SMILESO=C(NC1CCCCC1)c1cnc(C2CC2)[nH]c1=O
InChIInChI=1S/C14H19N3O2/c18-13(16-10-4-2-1-3-5-10)11-8-15-12(9-6-7-9)17-14(11)19/h8-10H,1-7H2,(H,16,18)(H,15,17,19)
InChIKeyPPHAYWOHMAIYGK-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.71
Rot. Bonds3

About N-cyclohexyl-2-cyclopropyl-6-oxo-1H-pyrimidine-5-carboxamide

N-cyclohexyl-2-cyclopropyl-6-oxo-1H-pyrimidine-5-carboxamide (PubChem CID 166253059) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is N-cyclohexyl-2-cyclopropyl-6-oxo-1H-pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-2-cyclopropyl-6-oxo-1H-pyrimidine-5-carboxamide
PubChem CID166253059
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC NameN-cyclohexyl-2-cyclopropyl-6-oxo-1H-pyrimidine-5-carboxamide
SMILESO=C(NC1CCCCC1)c1cnc(C2CC2)[nH]c1=O
InChIInChI=1S/C14H19N3O2/c18-13(16-10-4-2-1-3-5-10)11-8-15-12(9-6-7-9)17-14(11)19/h8-10H,1-7H2,(H,16,18)(H,15,17,19)
InChIKeyPPHAYWOHMAIYGK-UHFFFAOYSA-N
XLogP1.71
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(cyclohexylcarbamoyl)piperidin-4-yl]-2-cyclopropyl-6-oxo-1H-pyrimidine-5-carboxamide
CID 70747856
2-cyclopropyl-6-oxo-N-[(1R,2R)-2-phenylmethoxycyclopentyl]-1H-pyrimidine-5-carboxamide
CID 70737103
N-cyclohexyl-2-cyclopropyl-1H-imidazo[4,5-b]pyridine-7-carboxamide
CID 123817680
2-(4-ethylcyclohexyl)-6-oxo-1H-pyrimidine-5-carboxylic acid
CID 65390526
N-cyclohexyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 60708032
N-cycloheptyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 47017222
2-cyclobutyl-N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-6-oxo-1H-pyrimidine-5-carboxamide
CID 155962112
N-cyclohexyl-2-oxo-1H-quinoline-3-carboxamide
CID 11011060
N-cyclohexyl-5-ethyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 125491863
2-cyclopropyl-N-[(3S,4R)-4-(3-methylbut-2-enoxy)oxan-3-yl]-6-oxo-1H-pyrimidine-5-carboxamide
CID 133267808
2-cyclopropyl-N-[2-(1-methyltetrazol-5-yl)sulfanylethyl]-6-oxo-1H-pyrimidine-5-carboxamide
CID 70752444
2-cyclopropyl-N-[(1R)-1-(1-methylimidazol-2-yl)butyl]-6-oxo-1H-pyrimidine-5-carboxamide
CID 126440228

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-cyclopropyl-6-oxo-1H-pyrimidine-5-carboxamide?
The IUPAC name of N-cyclohexyl-2-cyclopropyl-6-oxo-1H-pyrimidine-5-carboxamide (CID 166253059) is N-cyclohexyl-2-cyclopropyl-6-oxo-1H-pyrimidine-5-carboxamide.
What is the SMILES notation for N-cyclohexyl-2-cyclopropyl-6-oxo-1H-pyrimidine-5-carboxamide?
The canonical SMILES for N-cyclohexyl-2-cyclopropyl-6-oxo-1H-pyrimidine-5-carboxamide is O=C(NC1CCCCC1)c1cnc(C2CC2)[nH]c1=O.
What is the InChIKey of N-cyclohexyl-2-cyclopropyl-6-oxo-1H-pyrimidine-5-carboxamide?
The InChIKey is PPHAYWOHMAIYGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c18-13(16-10-4-2-1-3-5-10)11-8-15-12(9-6-7-9)17-14(11)19/h8-10H,1-7H2,(H,16,18)(H,15,17,19).
What are the key properties of N-cyclohexyl-2-cyclopropyl-6-oxo-1H-pyrimidine-5-carboxamide?
N-cyclohexyl-2-cyclopropyl-6-oxo-1H-pyrimidine-5-carboxamide has a molecular weight of 261.32 g/mol, XLogP of 1.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-cyclopropyl-6-oxo-1H-pyrimidine-5-carboxamide is sourced from PubChem (CID 166253059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).