N-(1-cyclohexylpyrrolidin-3-yl)-3-(1H-pyrazol-4-yl)propanamide

C16H26N4O — CID 132984215

IUPACN-(1-cyclohexylpyrrolidin-3-yl)-3-(1H-pyrazol-4-yl)propanamide
SMILESO=C(CCc1cn[nH]c1)NC1CCN(C2CCCCC2)C1
InChIInChI=1S/C16H26N4O/c21-16(7-6-13-10-17-18-11-13)19-14-8-9-20(12-14)15-4-2-1-3-5-15/h10-11,14-15H,1-9,12H2,(H,17,18)(H,19,21)
InChIKeyKFLMTFHJHXYKCV-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.87
Rot. Bonds5

About N-(1-cyclohexylpyrrolidin-3-yl)-3-(1H-pyrazol-4-yl)propanamide

N-(1-cyclohexylpyrrolidin-3-yl)-3-(1H-pyrazol-4-yl)propanamide (PubChem CID 132984215) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(1-cyclohexylpyrrolidin-3-yl)-3-(1H-pyrazol-4-yl)propanamide.

Molecular Properties

Compound NameN-(1-cyclohexylpyrrolidin-3-yl)-3-(1H-pyrazol-4-yl)propanamide
PubChem CID132984215
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC NameN-(1-cyclohexylpyrrolidin-3-yl)-3-(1H-pyrazol-4-yl)propanamide
SMILESO=C(CCc1cn[nH]c1)NC1CCN(C2CCCCC2)C1
InChIInChI=1S/C16H26N4O/c21-16(7-6-13-10-17-18-11-13)19-14-8-9-20(12-14)15-4-2-1-3-5-15/h10-11,14-15H,1-9,12H2,(H,17,18)(H,19,21)
InChIKeyKFLMTFHJHXYKCV-UHFFFAOYSA-N
XLogP1.87
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]-3-(1H-pyrazol-4-yl)propanamide
CID 45178828
N-[1-(2-phenylethyl)piperidin-3-yl]-3-(1H-pyrazol-4-yl)propanamide
CID 45241321
N-[(3S)-1-cycloheptylpiperidin-3-yl]-3-(4-methoxyphenyl)propanamide
CID 42342863
N-[(3R)-1-cycloheptylpyrrolidin-3-yl]-3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propanamide
CID 95733913
4-(1H-pyrazol-4-yl)-N-[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]butanamide
CID 125165028
3-(4-aminophenyl)-N-(1-cyclopropylpiperidin-4-yl)propanamide
CID 115341221
N-(1-cyclohexylpiperidin-3-yl)-3-ethoxypropanamide
CID 56785441
N-(1-cyclopropylpyrrolidin-3-yl)-2H-triazole-4-carboxamide
CID 47937761
N-(1-cyclohexylpiperidin-3-yl)-2-pyridin-3-ylacetamide
CID 118788376
methyl N-(1-cyclohexylpyrrolidin-3-yl)carbamate
CID 110477693
N-(1-cycloheptylpiperidin-3-yl)-3-methylsulfanylpropanamide
CID 45243625
N-[2-(1-methylsulfonylpiperidin-2-yl)ethyl]-3-(1H-pyrazol-4-yl)propanamide
CID 118786414

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylpyrrolidin-3-yl)-3-(1H-pyrazol-4-yl)propanamide?
The IUPAC name of N-(1-cyclohexylpyrrolidin-3-yl)-3-(1H-pyrazol-4-yl)propanamide (CID 132984215) is N-(1-cyclohexylpyrrolidin-3-yl)-3-(1H-pyrazol-4-yl)propanamide.
What is the SMILES notation for N-(1-cyclohexylpyrrolidin-3-yl)-3-(1H-pyrazol-4-yl)propanamide?
The canonical SMILES for N-(1-cyclohexylpyrrolidin-3-yl)-3-(1H-pyrazol-4-yl)propanamide is O=C(CCc1cn[nH]c1)NC1CCN(C2CCCCC2)C1.
What is the InChIKey of N-(1-cyclohexylpyrrolidin-3-yl)-3-(1H-pyrazol-4-yl)propanamide?
The InChIKey is KFLMTFHJHXYKCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c21-16(7-6-13-10-17-18-11-13)19-14-8-9-20(12-14)15-4-2-1-3-5-15/h10-11,14-15H,1-9,12H2,(H,17,18)(H,19,21).
What are the key properties of N-(1-cyclohexylpyrrolidin-3-yl)-3-(1H-pyrazol-4-yl)propanamide?
N-(1-cyclohexylpyrrolidin-3-yl)-3-(1H-pyrazol-4-yl)propanamide has a molecular weight of 290.41 g/mol, XLogP of 1.87, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylpyrrolidin-3-yl)-3-(1H-pyrazol-4-yl)propanamide is sourced from PubChem (CID 132984215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).