4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide

C14H29N3O — CID 114428936

IUPAC4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NCCN(C)C(C)C)C1
InChIInChI=1S/C14H29N3O/c1-5-12-6-7-15-13(10-12)14(18)16-8-9-17(4)11(2)3/h11-13,15H,5-10H2,1-4H3,(H,16,18)
InChIKeyVSUPKBAGNADJEZ-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.22
Rot. Bonds6

About 4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide

4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide (PubChem CID 114428936) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide
PubChem CID114428936
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NCCN(C)C(C)C)C1
InChIInChI=1S/C14H29N3O/c1-5-12-6-7-15-13(10-12)14(18)16-8-9-17(4)11(2)3/h11-13,15H,5-10H2,1-4H3,(H,16,18)
InChIKeyVSUPKBAGNADJEZ-UHFFFAOYSA-N
XLogP1.22
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidine-2-carboxamide
CID 62639882
N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide
CID 62641689
4-ethyl-N-[2-(N-methylanilino)ethyl]piperidine-2-carboxamide
CID 114428740
4-ethyl-N-(3-hydroxypropyl)piperidine-2-carboxamide
CID 114428024
N-[2-(dimethylamino)-3-ethylpentyl]-4-ethylpiperidine-2-carboxamide
CID 114428728
4-methyl-N-[4-[methyl(propan-2-yl)amino]butyl]piperidine-2-carboxamide
CID 114423872
4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide
CID 106841954
(2S,4S)-2-methyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-4-carboxamide
CID 120635200
N-(2-cyclopentyloxyethyl)-4-ethylpiperidine-2-carboxamide
CID 114429058
N-[3-(cyclopropylmethoxy)propyl]-4-ethylpiperidine-2-carboxamide
CID 114428069
N-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide
CID 114428046
4-ethyl-N-propan-2-ylsulfonylpiperidine-2-carboxamide
CID 103307962

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide?
The IUPAC name of 4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide (CID 114428936) is 4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide.
What is the SMILES notation for 4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide?
The canonical SMILES for 4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide is CCC1CCNC(C(=O)NCCN(C)C(C)C)C1.
What is the InChIKey of 4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide?
The InChIKey is VSUPKBAGNADJEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-5-12-6-7-15-13(10-12)14(18)16-8-9-17(4)11(2)3/h11-13,15H,5-10H2,1-4H3,(H,16,18).
What are the key properties of 4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide?
4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide has a molecular weight of 255.41 g/mol, XLogP of 1.22, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide is sourced from PubChem (CID 114428936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).