N-cyclohexyl-4-[(4-ethoxybenzoyl)amino]piperidine-1-carboxamide

C21H31N3O3 — CID 3676198

IUPACN-cyclohexyl-4-[(4-ethoxybenzoyl)amino]piperidine-1-carboxamide
SMILESCCOc1ccc(C(=O)NC2CCN(C(=O)NC3CCCCC3)CC2)cc1
InChIInChI=1S/C21H31N3O3/c1-2-27-19-10-8-16(9-11-19)20(25)22-18-12-14-24(15-13-18)21(26)23-17-6-4-3-5-7-17/h8-11,17-18H,2-7,12-15H2,1H3,(H,22,25)(H,23,26)
InChIKeyFVGWGQDORSYXST-UHFFFAOYSA-N
MW373.50 g/mol
LogP3.32
Rot. Bonds5

About N-cyclohexyl-4-[(4-ethoxybenzoyl)amino]piperidine-1-carboxamide

N-cyclohexyl-4-[(4-ethoxybenzoyl)amino]piperidine-1-carboxamide (PubChem CID 3676198) has the molecular formula C21H31N3O3 and a molecular weight of 373.50 g/mol. Its IUPAC name is N-cyclohexyl-4-[(4-ethoxybenzoyl)amino]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-4-[(4-ethoxybenzoyl)amino]piperidine-1-carboxamide
PubChem CID3676198
Molecular FormulaC21H31N3O3
Molecular Weight373.50 g/mol
Exact Mass373.24
IUPAC NameN-cyclohexyl-4-[(4-ethoxybenzoyl)amino]piperidine-1-carboxamide
SMILESCCOc1ccc(C(=O)NC2CCN(C(=O)NC3CCCCC3)CC2)cc1
InChIInChI=1S/C21H31N3O3/c1-2-27-19-10-8-16(9-11-19)20(25)22-18-12-14-24(15-13-18)21(26)23-17-6-4-3-5-7-17/h8-11,17-18H,2-7,12-15H2,1H3,(H,22,25)(H,23,26)
InChIKeyFVGWGQDORSYXST-UHFFFAOYSA-N
XLogP3.32
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.50
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-4-[2-[(4-ethoxybenzoyl)amino]ethyl]piperidine-1-carboxamide
CID 46381876
ethyl 4-[(4-ethoxybenzoyl)amino]piperidine-1-carboxylate
CID 31542192
4-[(4-ethoxybenzoyl)amino]-N-(2-ethylphenyl)piperidine-1-carboxamide
CID 3218431
4-ethoxy-N-[1-[2-(4-methylphenoxy)acetyl]piperidin-4-yl]benzamide
CID 108551924
4-ethoxy-N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]benzamide
CID 108551932
4-ethoxy-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide
CID 108551846
N-cyclohexyl-4-propoxybenzamide
CID 4938429
N-[1-[2-(1-adamantyl)acetyl]piperidin-4-yl]-4-ethoxybenzamide
CID 108551861
N-[1-[2-(3,4-dimethylphenoxy)acetyl]piperidin-4-yl]-4-ethoxybenzamide
CID 108551882
4-(4-butoxybenzoyl)-N-cyclohexylpiperazine-1-carboxamide
CID 55558062
4-ethoxy-N-[1-[4-(methanesulfonamido)benzoyl]piperidin-4-yl]benzamide
CID 108551873
ethyl 4-[[4-[(1-ethoxycarbonylpiperidin-4-yl)carbamoyl]benzoyl]amino]piperidine-1-carboxylate
CID 24644255

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-[(4-ethoxybenzoyl)amino]piperidine-1-carboxamide?
The IUPAC name of N-cyclohexyl-4-[(4-ethoxybenzoyl)amino]piperidine-1-carboxamide (CID 3676198) is N-cyclohexyl-4-[(4-ethoxybenzoyl)amino]piperidine-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-4-[(4-ethoxybenzoyl)amino]piperidine-1-carboxamide?
The canonical SMILES for N-cyclohexyl-4-[(4-ethoxybenzoyl)amino]piperidine-1-carboxamide is CCOc1ccc(C(=O)NC2CCN(C(=O)NC3CCCCC3)CC2)cc1.
What is the InChIKey of N-cyclohexyl-4-[(4-ethoxybenzoyl)amino]piperidine-1-carboxamide?
The InChIKey is FVGWGQDORSYXST-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H31N3O3/c1-2-27-19-10-8-16(9-11-19)20(25)22-18-12-14-24(15-13-18)21(26)23-17-6-4-3-5-7-17/h8-11,17-18H,2-7,12-15H2,1H3,(H,22,25)(H,23,26).
What are the key properties of N-cyclohexyl-4-[(4-ethoxybenzoyl)amino]piperidine-1-carboxamide?
N-cyclohexyl-4-[(4-ethoxybenzoyl)amino]piperidine-1-carboxamide has a molecular weight of 373.50 g/mol, XLogP of 3.32, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-[(4-ethoxybenzoyl)amino]piperidine-1-carboxamide is sourced from PubChem (CID 3676198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).