1-(cyclopropanecarbonyl)-N-(3-ethylphenyl)piperidine-4-carboxamide

C18H24N2O2 — CID 26880034

IUPAC1-(cyclopropanecarbonyl)-N-(3-ethylphenyl)piperidine-4-carboxamide
SMILESCCc1cccc(NC(=O)C2CCN(C(=O)C3CC3)CC2)c1
InChIInChI=1S/C18H24N2O2/c1-2-13-4-3-5-16(12-13)19-17(21)14-8-10-20(11-9-14)18(22)15-6-7-15/h3-5,12,14-15H,2,6-11H2,1H3,(H,19,21)
InChIKeyMMMYKNYLRFVTRB-UHFFFAOYSA-N
MW300.40 g/mol
LogP2.84
Rot. Bonds4

About 1-(cyclopropanecarbonyl)-N-(3-ethylphenyl)piperidine-4-carboxamide

1-(cyclopropanecarbonyl)-N-(3-ethylphenyl)piperidine-4-carboxamide (PubChem CID 26880034) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is 1-(cyclopropanecarbonyl)-N-(3-ethylphenyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(cyclopropanecarbonyl)-N-(3-ethylphenyl)piperidine-4-carboxamide
PubChem CID26880034
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC Name1-(cyclopropanecarbonyl)-N-(3-ethylphenyl)piperidine-4-carboxamide
SMILESCCc1cccc(NC(=O)C2CCN(C(=O)C3CC3)CC2)c1
InChIInChI=1S/C18H24N2O2/c1-2-13-4-3-5-16(12-13)19-17(21)14-8-10-20(11-9-14)18(22)15-6-7-15/h3-5,12,14-15H,2,6-11H2,1H3,(H,19,21)
InChIKeyMMMYKNYLRFVTRB-UHFFFAOYSA-N
XLogP2.84
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cyclopropanecarbonyl)-N-(3-fluorophenyl)piperidine-4-carboxamide
CID 26086523
N-(3-ethylphenyl)-1-pyridin-4-ylpiperidine-4-carboxamide
CID 46384741
3-(cyclopropanecarbonylamino)-N-(3-ethylphenyl)benzamide
CID 32736931
N-(4-ethylphenyl)-4-(4-methylpiperidine-1-carbonyl)cyclohexane-1-carboxamide
CID 109146283
N-(3-ethylphenyl)-1-(3-oxo-4H-1,4-benzothiazine-2-carbonyl)piperidine-4-carboxamide
CID 46390668
4-(4-acetylpiperazine-1-carbonyl)-N-(4-ethylphenyl)cyclohexane-1-carboxamide
CID 109147720
1-[(3-ethylphenyl)carbamothioyl]-N-(2-hydroxyphenyl)piperidine-4-carboxamide
CID 9239016
1-(cyclopropanecarbonyl)-N-[3-(diethylaminomethyl)phenyl]piperidine-3-carboxamide
CID 55685452
N-[3-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]phenyl]cyclopropanecarboxamide
CID 31611202
N-(3-acetylphenyl)-1-propanoylpiperidine-4-carboxamide
CID 113007816
4-(4-ethylpiperazine-1-carbonyl)-N-(3-methoxyphenyl)cyclohexane-1-carboxamide
CID 109147563
N-(3-ethylphenyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 4810884

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropanecarbonyl)-N-(3-ethylphenyl)piperidine-4-carboxamide?
The IUPAC name of 1-(cyclopropanecarbonyl)-N-(3-ethylphenyl)piperidine-4-carboxamide (CID 26880034) is 1-(cyclopropanecarbonyl)-N-(3-ethylphenyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(cyclopropanecarbonyl)-N-(3-ethylphenyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(cyclopropanecarbonyl)-N-(3-ethylphenyl)piperidine-4-carboxamide is CCc1cccc(NC(=O)C2CCN(C(=O)C3CC3)CC2)c1.
What is the InChIKey of 1-(cyclopropanecarbonyl)-N-(3-ethylphenyl)piperidine-4-carboxamide?
The InChIKey is MMMYKNYLRFVTRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-2-13-4-3-5-16(12-13)19-17(21)14-8-10-20(11-9-14)18(22)15-6-7-15/h3-5,12,14-15H,2,6-11H2,1H3,(H,19,21).
What are the key properties of 1-(cyclopropanecarbonyl)-N-(3-ethylphenyl)piperidine-4-carboxamide?
1-(cyclopropanecarbonyl)-N-(3-ethylphenyl)piperidine-4-carboxamide has a molecular weight of 300.40 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropanecarbonyl)-N-(3-ethylphenyl)piperidine-4-carboxamide is sourced from PubChem (CID 26880034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).