1-butan-2-yl-N,N-dimethylpiperidine-4-carboxamide

C12H24N2O — CID 154662665

IUPAC1-butan-2-yl-N,N-dimethylpiperidine-4-carboxamide
SMILESCCC(C)N1CCC(C(=O)N(C)C)CC1
InChIInChI=1S/C12H24N2O/c1-5-10(2)14-8-6-11(7-9-14)12(15)13(3)4/h10-11H,5-9H2,1-4H3
InChIKeyCLFGHCJVBZEGPB-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.59
Rot. Bonds3

About 1-butan-2-yl-N,N-dimethylpiperidine-4-carboxamide

1-butan-2-yl-N,N-dimethylpiperidine-4-carboxamide (PubChem CID 154662665) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 1-butan-2-yl-N,N-dimethylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-butan-2-yl-N,N-dimethylpiperidine-4-carboxamide
PubChem CID154662665
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name1-butan-2-yl-N,N-dimethylpiperidine-4-carboxamide
SMILESCCC(C)N1CCC(C(=O)N(C)C)CC1
InChIInChI=1S/C12H24N2O/c1-5-10(2)14-8-6-11(7-9-14)12(15)13(3)4/h10-11H,5-9H2,1-4H3
InChIKeyCLFGHCJVBZEGPB-UHFFFAOYSA-N
XLogP1.59
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-butan-2-ylpiperidine-4-carboxylic acid
CID 43441619
ethyl 1-butan-2-ylpiperidine-4-carboxylate
CID 62027270
N,N-dimethyl-1-(2-methylpropyl)piperidine-4-carboxamide
CID 59603411
1-butan-2-yl-N,N-dimethylpiperidin-4-amine
CID 90697678
1-[(2S)-2-aminobutanoyl]-N,N-dimethylpiperidine-4-carboxamide
CID 79024849
N,N-dimethyl-1-(1-oxo-1-piperidin-1-ylpropan-2-yl)piperidine-4-carboxamide
CID 78788245
N,N-dimethyl-1-(3-methylbutyl)piperidine-4-carboxamide
CID 175620267
1-(4-hydroxypentanoyl)-N,N-dimethylpiperidine-4-carboxamide
CID 79200487
1-(2-hydroxyacetyl)-N,N-dimethylpiperidine-4-carboxamide
CID 170068801
N,N-dimethyl-4-propan-2-ylcyclohexane-1-carboxamide
CID 12518171
N,N-dimethyl-1-[2-methyl-3-(methylamino)propanoyl]piperidine-4-carboxamide
CID 79202506
1-[(2S)-2-amino-3-methylbutanoyl]-N,N-dimethylpiperidine-4-carboxamide
CID 61162789

Frequently Asked Questions

What is the IUPAC name of 1-butan-2-yl-N,N-dimethylpiperidine-4-carboxamide?
The IUPAC name of 1-butan-2-yl-N,N-dimethylpiperidine-4-carboxamide (CID 154662665) is 1-butan-2-yl-N,N-dimethylpiperidine-4-carboxamide.
What is the SMILES notation for 1-butan-2-yl-N,N-dimethylpiperidine-4-carboxamide?
The canonical SMILES for 1-butan-2-yl-N,N-dimethylpiperidine-4-carboxamide is CCC(C)N1CCC(C(=O)N(C)C)CC1.
What is the InChIKey of 1-butan-2-yl-N,N-dimethylpiperidine-4-carboxamide?
The InChIKey is CLFGHCJVBZEGPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-5-10(2)14-8-6-11(7-9-14)12(15)13(3)4/h10-11H,5-9H2,1-4H3.
What are the key properties of 1-butan-2-yl-N,N-dimethylpiperidine-4-carboxamide?
1-butan-2-yl-N,N-dimethylpiperidine-4-carboxamide has a molecular weight of 212.34 g/mol, XLogP of 1.59, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butan-2-yl-N,N-dimethylpiperidine-4-carboxamide is sourced from PubChem (CID 154662665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).