N-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide

C15H28N2O — CID 114428046

IUPACN-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NCC2CCCCC2)C1
InChIInChI=1S/C15H28N2O/c1-2-12-8-9-16-14(10-12)15(18)17-11-13-6-4-3-5-7-13/h12-14,16H,2-11H2,1H3,(H,17,18)
InChIKeyWYNRVWMQXIECFH-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.46
Rot. Bonds4

About N-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide

N-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide (PubChem CID 114428046) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide
PubChem CID114428046
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC NameN-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NCC2CCCCC2)C1
InChIInChI=1S/C15H28N2O/c1-2-12-8-9-16-14(10-12)15(18)17-11-13-6-4-3-5-7-13/h12-14,16H,2-11H2,1H3,(H,17,18)
InChIKeyWYNRVWMQXIECFH-UHFFFAOYSA-N
XLogP2.46
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide?
The IUPAC name of N-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide (CID 114428046) is N-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide.
What is the SMILES notation for N-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide?
The canonical SMILES for N-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide is CCC1CCNC(C(=O)NCC2CCCCC2)C1.
What is the InChIKey of N-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide?
The InChIKey is WYNRVWMQXIECFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-2-12-8-9-16-14(10-12)15(18)17-11-13-6-4-3-5-7-13/h12-14,16H,2-11H2,1H3,(H,17,18).
What are the key properties of N-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide?
N-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide has a molecular weight of 252.40 g/mol, XLogP of 2.46, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide is sourced from PubChem (CID 114428046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).