N-cyclohexyl-4-[2-(cyclohexylcarbamoylamino)ethyl]piperidine-1-carboxamide

C21H38N4O2 — CID 46381833

IUPACN-cyclohexyl-4-[2-(cyclohexylcarbamoylamino)ethyl]piperidine-1-carboxamide
SMILESO=C(NCCC1CCN(C(=O)NC2CCCCC2)CC1)NC1CCCCC1
InChIInChI=1S/C21H38N4O2/c26-20(23-18-7-3-1-4-8-18)22-14-11-17-12-15-25(16-13-17)21(27)24-19-9-5-2-6-10-19/h17-19H,1-16H2,(H,24,27)(H2,22,23,26)
InChIKeyGRUGWMQNYORGPA-UHFFFAOYSA-N
MW378.56 g/mol
LogP3.76
Rot. Bonds5

About N-cyclohexyl-4-[2-(cyclohexylcarbamoylamino)ethyl]piperidine-1-carboxamide

N-cyclohexyl-4-[2-(cyclohexylcarbamoylamino)ethyl]piperidine-1-carboxamide (PubChem CID 46381833) has the molecular formula C21H38N4O2 and a molecular weight of 378.56 g/mol. Its IUPAC name is N-cyclohexyl-4-[2-(cyclohexylcarbamoylamino)ethyl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-4-[2-(cyclohexylcarbamoylamino)ethyl]piperidine-1-carboxamide
PubChem CID46381833
Molecular FormulaC21H38N4O2
Molecular Weight378.56 g/mol
Exact Mass378.30
IUPAC NameN-cyclohexyl-4-[2-(cyclohexylcarbamoylamino)ethyl]piperidine-1-carboxamide
SMILESO=C(NCCC1CCN(C(=O)NC2CCCCC2)CC1)NC1CCCCC1
InChIInChI=1S/C21H38N4O2/c26-20(23-18-7-3-1-4-8-18)22-14-11-17-12-15-25(16-13-17)21(27)24-19-9-5-2-6-10-19/h17-19H,1-16H2,(H,24,27)(H2,22,23,26)
InChIKeyGRUGWMQNYORGPA-UHFFFAOYSA-N
XLogP3.76
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.56
LogP ≤ 53.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

Piperidine-1,4-dicarboxylic acid 1-cyclohexylamide 4-cyclohexylmethyl-amide
CID 654301
N-cyclohexyl-4-[2-(cyclohexylcarbamoylamino)ethyl]piperazine-1-carboxamide
CID 655271
N-cyclohexyl-4-methylpiperidine-1-carboxamide
CID 4207227
N-(2-methoxyphenyl)-1,2-dimethyl-5-[4-methyl-5-(morpholin-4-ylcarbonyl)-1,3-thiazol-2-yl]-1H-pyrrole-3-sulfonamide
CID 46381822
N-cyclohexyl-4-[2-(cyclopentylcarbamamido)ethyl]piperidine-1-carboxamide
CID 46381823
4-(2-{[(sec-butylamino)carbonyl]amino}ethyl)-N-cyclohexyltetrahydro-1(2H)-pyridinecarboxamide
CID 46381831
N-cyclohexyl-4-{2-[(3-methylbutyl)carbamamido]ethyl}piperidine-1-carboxamide
CID 46381832
1-acetyl-N-(3-bromophenyl)-3,3-dimethylindoline-5-sulfonamide
CID 46381837
N~1~-cyclohexyl-4-[2-(isobutyrylamino)ethyl]tetrahydro-1(2H)-pyridinecarboxamide
CID 46381862
N-Cyclohexyl-4-(2-propanamidoethyl)piperidine-1-carboxamide
CID 46381869
N~1~-Cyclohexyl-4-{2-[(3-methylbutanoyl)amino]ethyl}tetrahydro-1(2H)-pyridinecarboxamide
CID 46381879
N-Cyclohexyl-4-[2-(2-ethylbutanamido)ethyl]piperidine-1-carboxamide
CID 46381881

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-[2-(cyclohexylcarbamoylamino)ethyl]piperidine-1-carboxamide?
The IUPAC name of N-cyclohexyl-4-[2-(cyclohexylcarbamoylamino)ethyl]piperidine-1-carboxamide (CID 46381833) is N-cyclohexyl-4-[2-(cyclohexylcarbamoylamino)ethyl]piperidine-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-4-[2-(cyclohexylcarbamoylamino)ethyl]piperidine-1-carboxamide?
The canonical SMILES for N-cyclohexyl-4-[2-(cyclohexylcarbamoylamino)ethyl]piperidine-1-carboxamide is O=C(NCCC1CCN(C(=O)NC2CCCCC2)CC1)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-4-[2-(cyclohexylcarbamoylamino)ethyl]piperidine-1-carboxamide?
The InChIKey is GRUGWMQNYORGPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H38N4O2/c26-20(23-18-7-3-1-4-8-18)22-14-11-17-12-15-25(16-13-17)21(27)24-19-9-5-2-6-10-19/h17-19H,1-16H2,(H,24,27)(H2,22,23,26).
What are the key properties of N-cyclohexyl-4-[2-(cyclohexylcarbamoylamino)ethyl]piperidine-1-carboxamide?
N-cyclohexyl-4-[2-(cyclohexylcarbamoylamino)ethyl]piperidine-1-carboxamide has a molecular weight of 378.56 g/mol, XLogP of 3.76, 5 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-[2-(cyclohexylcarbamoylamino)ethyl]piperidine-1-carboxamide is sourced from PubChem (CID 46381833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).