N-[cyclopropyl(phenyl)methyl]-3-ethylpiperidine-3-carboxamide

C18H26N2O — CID 63131063

IUPACN-[cyclopropyl(phenyl)methyl]-3-ethylpiperidine-3-carboxamide
SMILESCCC1(C(=O)NC(c2ccccc2)C2CC2)CCCNC1
InChIInChI=1S/C18H26N2O/c1-2-18(11-6-12-19-13-18)17(21)20-16(15-9-10-15)14-7-4-3-5-8-14/h3-5,7-8,15-16,19H,2,6,9-13H2,1H3,(H,20,21)
InChIKeyUYAVFEWZGCQVFO-UHFFFAOYSA-N
MW286.42 g/mol
LogP3.03
Rot. Bonds5

About N-[cyclopropyl(phenyl)methyl]-3-ethylpiperidine-3-carboxamide

N-[cyclopropyl(phenyl)methyl]-3-ethylpiperidine-3-carboxamide (PubChem CID 63131063) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is N-[cyclopropyl(phenyl)methyl]-3-ethylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-[cyclopropyl(phenyl)methyl]-3-ethylpiperidine-3-carboxamide
PubChem CID63131063
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC NameN-[cyclopropyl(phenyl)methyl]-3-ethylpiperidine-3-carboxamide
SMILESCCC1(C(=O)NC(c2ccccc2)C2CC2)CCCNC1
InChIInChI=1S/C18H26N2O/c1-2-18(11-6-12-19-13-18)17(21)20-16(15-9-10-15)14-7-4-3-5-8-14/h3-5,7-8,15-16,19H,2,6,9-13H2,1H3,(H,20,21)
InChIKeyUYAVFEWZGCQVFO-UHFFFAOYSA-N
XLogP3.03
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-N-(1-phenylethyl)piperidine-3-carboxamide
CID 63132202
N-[1-(2-bromophenyl)ethyl]-3-ethylpiperidine-3-carboxamide
CID 63130128
N-[(1R)-2-hydroxy-1-phenylethyl]-3-propylpiperidine-3-carboxamide
CID 107863291
3-ethyl-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide
CID 63130581
3-ethyl-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide
CID 81407453
3-ethyl-N-(2-methyl-1-thiophen-2-ylpropyl)piperidine-3-carboxamide
CID 63130877
3-[(3-ethylpiperidine-3-carbonyl)amino]benzoic acid
CID 63131356
N-[(1R)-1-cycloheptylethyl]-3-ethylpyrrolidine-3-carboxamide
CID 81391921
3-ethyl-N-[4-(furan-2-yl)butan-2-yl]piperidine-3-carboxamide
CID 63134948
N-(2,6-diethylphenyl)-3-ethylpiperidine-3-carboxamide
CID 63132509
N-(cyclopropylmethyl)-3-ethylpiperidine-3-carboxamide
CID 63132114
N-(3-bromophenyl)-3-ethylpiperidine-3-carboxamide
CID 63132260

Frequently Asked Questions

What is the IUPAC name of N-[cyclopropyl(phenyl)methyl]-3-ethylpiperidine-3-carboxamide?
The IUPAC name of N-[cyclopropyl(phenyl)methyl]-3-ethylpiperidine-3-carboxamide (CID 63131063) is N-[cyclopropyl(phenyl)methyl]-3-ethylpiperidine-3-carboxamide.
What is the SMILES notation for N-[cyclopropyl(phenyl)methyl]-3-ethylpiperidine-3-carboxamide?
The canonical SMILES for N-[cyclopropyl(phenyl)methyl]-3-ethylpiperidine-3-carboxamide is CCC1(C(=O)NC(c2ccccc2)C2CC2)CCCNC1.
What is the InChIKey of N-[cyclopropyl(phenyl)methyl]-3-ethylpiperidine-3-carboxamide?
The InChIKey is UYAVFEWZGCQVFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-2-18(11-6-12-19-13-18)17(21)20-16(15-9-10-15)14-7-4-3-5-8-14/h3-5,7-8,15-16,19H,2,6,9-13H2,1H3,(H,20,21).
What are the key properties of N-[cyclopropyl(phenyl)methyl]-3-ethylpiperidine-3-carboxamide?
N-[cyclopropyl(phenyl)methyl]-3-ethylpiperidine-3-carboxamide has a molecular weight of 286.42 g/mol, XLogP of 3.03, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopropyl(phenyl)methyl]-3-ethylpiperidine-3-carboxamide is sourced from PubChem (CID 63131063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).