1-[4-(cyclopropanecarbonylamino)benzoyl]-N-ethylpiperidine-4-carboxamide

C19H25N3O3 — CID 32994989

IUPAC1-[4-(cyclopropanecarbonylamino)benzoyl]-N-ethylpiperidine-4-carboxamide
SMILESCCNC(=O)C1CCN(C(=O)c2ccc(NC(=O)C3CC3)cc2)CC1
InChIInChI=1S/C19H25N3O3/c1-2-20-17(23)14-9-11-22(12-10-14)19(25)15-5-7-16(8-6-15)21-18(24)13-3-4-13/h5-8,13-14H,2-4,9-12H2,1H3,(H,20,23)(H,21,24)
InChIKeyDRRKRICNNAYJHP-UHFFFAOYSA-N
MW343.43 g/mol
LogP2.02
Rot. Bonds5

About 1-[4-(cyclopropanecarbonylamino)benzoyl]-N-ethylpiperidine-4-carboxamide

1-[4-(cyclopropanecarbonylamino)benzoyl]-N-ethylpiperidine-4-carboxamide (PubChem CID 32994989) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is 1-[4-(cyclopropanecarbonylamino)benzoyl]-N-ethylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-[4-(cyclopropanecarbonylamino)benzoyl]-N-ethylpiperidine-4-carboxamide
PubChem CID32994989
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC Name1-[4-(cyclopropanecarbonylamino)benzoyl]-N-ethylpiperidine-4-carboxamide
SMILESCCNC(=O)C1CCN(C(=O)c2ccc(NC(=O)C3CC3)cc2)CC1
InChIInChI=1S/C19H25N3O3/c1-2-20-17(23)14-9-11-22(12-10-14)19(25)15-5-7-16(8-6-15)21-18(24)13-3-4-13/h5-8,13-14H,2-4,9-12H2,1H3,(H,20,23)(H,21,24)
InChIKeyDRRKRICNNAYJHP-UHFFFAOYSA-N
XLogP2.02
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-aminobenzoyl)-N-ethylpiperidine-4-carboxamide
CID 60963126
1-[4-(cyclopropanecarbonylamino)phenyl]-N-ethylpiperidine-4-carboxamide
CID 110668128
N-(4-ethylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide
CID 113006644
N-ethyl-1-[4-(trifluoromethyl)benzoyl]piperidine-4-carboxamide
CID 51309590
N-methyl-1-[4-(propanoylamino)benzoyl]piperidine-4-carboxamide
CID 20973011
4-[(1-benzoylpiperidine-4-carbonyl)amino]benzoic acid
CID 119177742
1-(4-tert-butylbenzoyl)-N-(4-ethylphenyl)piperidine-4-carboxamide
CID 113006650
N-(4-acetylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide
CID 113007858
N-(4-acetamidophenyl)-1-(4-bromobenzoyl)piperidine-4-carboxamide
CID 35049074
N-butyl-1-[4-(cyclopropanecarbonylamino)benzoyl]-N-methylpiperidine-4-carboxamide
CID 55836292
N-[4-(4-acetyl-1,4-diazepane-1-carbonyl)phenyl]cyclopropanecarboxamide
CID 134061665
1-[4-(2,2-dimethylpropanoylamino)benzoyl]-N-propylpiperidine-4-carboxamide
CID 20973017

Frequently Asked Questions

What is the IUPAC name of 1-[4-(cyclopropanecarbonylamino)benzoyl]-N-ethylpiperidine-4-carboxamide?
The IUPAC name of 1-[4-(cyclopropanecarbonylamino)benzoyl]-N-ethylpiperidine-4-carboxamide (CID 32994989) is 1-[4-(cyclopropanecarbonylamino)benzoyl]-N-ethylpiperidine-4-carboxamide.
What is the SMILES notation for 1-[4-(cyclopropanecarbonylamino)benzoyl]-N-ethylpiperidine-4-carboxamide?
The canonical SMILES for 1-[4-(cyclopropanecarbonylamino)benzoyl]-N-ethylpiperidine-4-carboxamide is CCNC(=O)C1CCN(C(=O)c2ccc(NC(=O)C3CC3)cc2)CC1.
What is the InChIKey of 1-[4-(cyclopropanecarbonylamino)benzoyl]-N-ethylpiperidine-4-carboxamide?
The InChIKey is DRRKRICNNAYJHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-2-20-17(23)14-9-11-22(12-10-14)19(25)15-5-7-16(8-6-15)21-18(24)13-3-4-13/h5-8,13-14H,2-4,9-12H2,1H3,(H,20,23)(H,21,24).
What are the key properties of 1-[4-(cyclopropanecarbonylamino)benzoyl]-N-ethylpiperidine-4-carboxamide?
1-[4-(cyclopropanecarbonylamino)benzoyl]-N-ethylpiperidine-4-carboxamide has a molecular weight of 343.43 g/mol, XLogP of 2.02, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(cyclopropanecarbonylamino)benzoyl]-N-ethylpiperidine-4-carboxamide is sourced from PubChem (CID 32994989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).