N-butyl-3,5-dimethylpiperidine-1-carboxamide

C12H24N2O — CID 2926433

IUPACN-butyl-3,5-dimethylpiperidine-1-carboxamide
SMILESCCCCNC(=O)N1CC(C)CC(C)C1
InChIInChI=1S/C12H24N2O/c1-4-5-6-13-12(15)14-8-10(2)7-11(3)9-14/h10-11H,4-9H2,1-3H3,(H,13,15)
InChIKeySGVTYGFNJXDUOE-UHFFFAOYSA-N
MW212.34 g/mol
LogP2.47
Rot. Bonds3

About N-butyl-3,5-dimethylpiperidine-1-carboxamide

N-butyl-3,5-dimethylpiperidine-1-carboxamide (PubChem CID 2926433) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is N-butyl-3,5-dimethylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-butyl-3,5-dimethylpiperidine-1-carboxamide
PubChem CID2926433
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC NameN-butyl-3,5-dimethylpiperidine-1-carboxamide
SMILESCCCCNC(=O)N1CC(C)CC(C)C1
InChIInChI=1S/C12H24N2O/c1-4-5-6-13-12(15)14-8-10(2)7-11(3)9-14/h10-11H,4-9H2,1-3H3,(H,13,15)
InChIKeySGVTYGFNJXDUOE-UHFFFAOYSA-N
XLogP2.47
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-butyl-3,5-dimethylpiperidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-Methyl-1-piperidinecarboxamide
CID 3442879
3-Methylpiperidine-1-carboxamide
CID 16786142
(Piperidin-3-ylmethyl)urea
CID 20115193
3-Methyl-1-(1-methylpiperidin-4-yl)urea
CID 59833286
3-Methyl-1-((piperidin-4-yl)methyl)urea hydrochloride
CID 134691041
5-Methyl-5-(2-methylpropyl)-1,3-diazinan-2-one
CID 257063
1-Cyclopropyl-3-[2-(4-methylpiperidin-1-yl)ethyl]urea
CID 47038655
1-(2-Methyl-2-methylsulfanylpropyl)-3-[2-(1-methylpiperidin-4-yl)ethyl]urea
CID 71868349
N-(2,2-difluoroethyl)-3-methylpiperidine-1-carboxamide
CID 84595795
Isohexylharnstoff
CID 20600822
n-Butylpiperidine-1-carboxamide
CID 256864
2-methyl-N-propylpiperidine-1-carboxamide
CID 6468414

Frequently Asked Questions

What is the IUPAC name of N-butyl-3,5-dimethylpiperidine-1-carboxamide?
The IUPAC name of N-butyl-3,5-dimethylpiperidine-1-carboxamide (CID 2926433) is N-butyl-3,5-dimethylpiperidine-1-carboxamide.
What is the SMILES notation for N-butyl-3,5-dimethylpiperidine-1-carboxamide?
The canonical SMILES for N-butyl-3,5-dimethylpiperidine-1-carboxamide is CCCCNC(=O)N1CC(C)CC(C)C1.
What is the InChIKey of N-butyl-3,5-dimethylpiperidine-1-carboxamide?
The InChIKey is SGVTYGFNJXDUOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-4-5-6-13-12(15)14-8-10(2)7-11(3)9-14/h10-11H,4-9H2,1-3H3,(H,13,15).
What are the key properties of N-butyl-3,5-dimethylpiperidine-1-carboxamide?
N-butyl-3,5-dimethylpiperidine-1-carboxamide has a molecular weight of 212.34 g/mol, XLogP of 2.47, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-3,5-dimethylpiperidine-1-carboxamide is sourced from PubChem (CID 2926433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).