N-[2-[cyclopentyl(methyl)amino]ethyl]-3-ethylpiperidine-3-carboxamide

C16H31N3O — CID 63316367

IUPACN-[2-[cyclopentyl(methyl)amino]ethyl]-3-ethylpiperidine-3-carboxamide
SMILESCCC1(C(=O)NCCN(C)C2CCCC2)CCCNC1
InChIInChI=1S/C16H31N3O/c1-3-16(9-6-10-17-13-16)15(20)18-11-12-19(2)14-7-4-5-8-14/h14,17H,3-13H2,1-2H3,(H,18,20)
InChIKeyJATVTHROVJXQEJ-UHFFFAOYSA-N
MW281.44 g/mol
LogP1.76
Rot. Bonds6

About N-[2-[cyclopentyl(methyl)amino]ethyl]-3-ethylpiperidine-3-carboxamide

N-[2-[cyclopentyl(methyl)amino]ethyl]-3-ethylpiperidine-3-carboxamide (PubChem CID 63316367) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is N-[2-[cyclopentyl(methyl)amino]ethyl]-3-ethylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-[2-[cyclopentyl(methyl)amino]ethyl]-3-ethylpiperidine-3-carboxamide
PubChem CID63316367
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC NameN-[2-[cyclopentyl(methyl)amino]ethyl]-3-ethylpiperidine-3-carboxamide
SMILESCCC1(C(=O)NCCN(C)C2CCCC2)CCCNC1
InChIInChI=1S/C16H31N3O/c1-3-16(9-6-10-17-13-16)15(20)18-11-12-19(2)14-7-4-5-8-14/h14,17H,3-13H2,1-2H3,(H,18,20)
InChIKeyJATVTHROVJXQEJ-UHFFFAOYSA-N
XLogP1.76
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-acetamidoethyl)-3-ethylpiperidine-3-carboxamide
CID 63130017
N-(cyclopropylmethyl)-3-ethylpiperidine-3-carboxamide
CID 63132114
3-[(3-ethylpiperidine-3-carbonyl)amino]propanoic acid
CID 63131870
N-(3-amino-3-oxopropyl)-3-ethylpiperidine-3-carboxamide
CID 63130061
N-cycloheptyl-3-ethyl-N-methylpiperidine-3-carboxamide
CID 63130331
3-ethyl-N-(2-methylsulfonylethyl)piperidine-3-carboxamide
CID 63131031
1-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]cyclohexane-1-carboxamide;dihydrochloride
CID 119878774
3-ethyl-N-[2-(4-fluorophenyl)ethyl]piperidine-3-carboxamide
CID 63132469
3-ethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidine-3-carboxamide
CID 55260889
3-ethyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)piperidine-3-carboxamide
CID 63135374
3-ethyl-N-[2-(methylamino)-2-oxoethyl]piperidine-3-carboxamide
CID 63130528
N-[2-(2-amino-2-oxoethoxy)ethyl]-3-ethylpiperidine-3-carboxamide
CID 106236645

Frequently Asked Questions

What is the IUPAC name of N-[2-[cyclopentyl(methyl)amino]ethyl]-3-ethylpiperidine-3-carboxamide?
The IUPAC name of N-[2-[cyclopentyl(methyl)amino]ethyl]-3-ethylpiperidine-3-carboxamide (CID 63316367) is N-[2-[cyclopentyl(methyl)amino]ethyl]-3-ethylpiperidine-3-carboxamide.
What is the SMILES notation for N-[2-[cyclopentyl(methyl)amino]ethyl]-3-ethylpiperidine-3-carboxamide?
The canonical SMILES for N-[2-[cyclopentyl(methyl)amino]ethyl]-3-ethylpiperidine-3-carboxamide is CCC1(C(=O)NCCN(C)C2CCCC2)CCCNC1.
What is the InChIKey of N-[2-[cyclopentyl(methyl)amino]ethyl]-3-ethylpiperidine-3-carboxamide?
The InChIKey is JATVTHROVJXQEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c1-3-16(9-6-10-17-13-16)15(20)18-11-12-19(2)14-7-4-5-8-14/h14,17H,3-13H2,1-2H3,(H,18,20).
What are the key properties of N-[2-[cyclopentyl(methyl)amino]ethyl]-3-ethylpiperidine-3-carboxamide?
N-[2-[cyclopentyl(methyl)amino]ethyl]-3-ethylpiperidine-3-carboxamide has a molecular weight of 281.44 g/mol, XLogP of 1.76, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[cyclopentyl(methyl)amino]ethyl]-3-ethylpiperidine-3-carboxamide is sourced from PubChem (CID 63316367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).