N-[1-(dimethylamino)propan-2-yl]-4-ethylpiperidine-4-carboxamide

C13H27N3O — CID 82939518

IUPACN-[1-(dimethylamino)propan-2-yl]-4-ethylpiperidine-4-carboxamide
SMILESCCC1(C(=O)NC(C)CN(C)C)CCNCC1
InChIInChI=1S/C13H27N3O/c1-5-13(6-8-14-9-7-13)12(17)15-11(2)10-16(3)4/h11,14H,5-10H2,1-4H3,(H,15,17)
InChIKeySFOCGSNWBHJQRS-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.83
Rot. Bonds5

About N-[1-(dimethylamino)propan-2-yl]-4-ethylpiperidine-4-carboxamide

N-[1-(dimethylamino)propan-2-yl]-4-ethylpiperidine-4-carboxamide (PubChem CID 82939518) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is N-[1-(dimethylamino)propan-2-yl]-4-ethylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[1-(dimethylamino)propan-2-yl]-4-ethylpiperidine-4-carboxamide
PubChem CID82939518
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC NameN-[1-(dimethylamino)propan-2-yl]-4-ethylpiperidine-4-carboxamide
SMILESCCC1(C(=O)NC(C)CN(C)C)CCNCC1
InChIInChI=1S/C13H27N3O/c1-5-13(6-8-14-9-7-13)12(17)15-11(2)10-16(3)4/h11,14H,5-10H2,1-4H3,(H,15,17)
InChIKeySFOCGSNWBHJQRS-UHFFFAOYSA-N
XLogP0.83
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-N-[(2S)-1-hydroxypropan-2-yl]piperidine-4-carboxamide
CID 107218997
N-[1-(dimethylamino)-3-methylbutan-2-yl]-3-ethylpyrrolidine-3-carboxamide
CID 63142451
4-ethyl-N-(1-methylsulfonylpropan-2-yl)piperidine-4-carboxamide
CID 64642235
4-ethyl-N-(3-ethylpentan-2-yl)piperidine-4-carboxamide
CID 63843351
N-[1-(dimethylamino)propan-2-yl]-3-(trifluoromethyl)pyrrolidine-3-carboxamide
CID 82945350
N-[(1S)-1-cyclopentylethyl]-4-ethylpiperidine-4-carboxamide
CID 81390475
N-[(1R)-1-cyclohexylethyl]-4-ethylpiperidine-4-carboxamide
CID 81385512
N-(1-hydroxypropan-2-yl)-4-propylpiperidine-4-carboxamide
CID 63127682
4-ethyl-N-octan-4-ylpiperidine-4-carboxamide
CID 106025848
4-ethyl-N-(1-hydroxypropan-2-yl)-N-methylpiperidine-4-carboxamide
CID 104551835
3-[(4-propylpiperidine-4-carbonyl)amino]butanoic acid
CID 63128810
(2S)-2-[(3-ethylpyrrolidine-3-carbonyl)amino]propanoic acid
CID 63141520

Frequently Asked Questions

What is the IUPAC name of N-[1-(dimethylamino)propan-2-yl]-4-ethylpiperidine-4-carboxamide?
The IUPAC name of N-[1-(dimethylamino)propan-2-yl]-4-ethylpiperidine-4-carboxamide (CID 82939518) is N-[1-(dimethylamino)propan-2-yl]-4-ethylpiperidine-4-carboxamide.
What is the SMILES notation for N-[1-(dimethylamino)propan-2-yl]-4-ethylpiperidine-4-carboxamide?
The canonical SMILES for N-[1-(dimethylamino)propan-2-yl]-4-ethylpiperidine-4-carboxamide is CCC1(C(=O)NC(C)CN(C)C)CCNCC1.
What is the InChIKey of N-[1-(dimethylamino)propan-2-yl]-4-ethylpiperidine-4-carboxamide?
The InChIKey is SFOCGSNWBHJQRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-5-13(6-8-14-9-7-13)12(17)15-11(2)10-16(3)4/h11,14H,5-10H2,1-4H3,(H,15,17).
What are the key properties of N-[1-(dimethylamino)propan-2-yl]-4-ethylpiperidine-4-carboxamide?
N-[1-(dimethylamino)propan-2-yl]-4-ethylpiperidine-4-carboxamide has a molecular weight of 241.38 g/mol, XLogP of 0.83, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(dimethylamino)propan-2-yl]-4-ethylpiperidine-4-carboxamide is sourced from PubChem (CID 82939518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).