N-benzyl-4,4-dimethylpiperidine-1-carboxamide

C15H22N2O — CID 110749470

IUPACN-benzyl-4,4-dimethylpiperidine-1-carboxamide
SMILESCC1(C)CCN(C(=O)NCc2ccccc2)CC1
InChIInChI=1S/C15H22N2O/c1-15(2)8-10-17(11-9-15)14(18)16-12-13-6-4-3-5-7-13/h3-7H,8-12H2,1-2H3,(H,16,18)
InChIKeyQKLAMQVLLLNDTO-UHFFFAOYSA-N
MW246.35 g/mol
LogP3.02
Rot. Bonds2

About N-benzyl-4,4-dimethylpiperidine-1-carboxamide

N-benzyl-4,4-dimethylpiperidine-1-carboxamide (PubChem CID 110749470) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-benzyl-4,4-dimethylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-benzyl-4,4-dimethylpiperidine-1-carboxamide
PubChem CID110749470
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-benzyl-4,4-dimethylpiperidine-1-carboxamide
SMILESCC1(C)CCN(C(=O)NCc2ccccc2)CC1
InChIInChI=1S/C15H22N2O/c1-15(2)8-10-17(11-9-15)14(18)16-12-13-6-4-3-5-7-13/h3-7H,8-12H2,1-2H3,(H,16,18)
InChIKeyQKLAMQVLLLNDTO-UHFFFAOYSA-N
XLogP3.02
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-benzyl-4,4-dimethylazepane-1-carboxamide
CID 103713688
3-[[(4,4-dimethylpiperidine-1-carbonyl)amino]methyl]benzoic acid
CID 62930165
N-benzyl-4-carbamothioyl-4-methylpiperidine-1-carboxamide
CID 107653594
N-benzyl-4-methylpiperidine-1-carboxamide
CID 18715459
N-benzyl-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide
CID 3729330
N-benzylazonane-1-carboxamide
CID 130689649
N-benzyl-N',3,3-trimethylpyrrolidine-1-carboximidamide
CID 111738646
7-acetyl-N-benzyl-2,7-diazaspiro[3.4]octane-2-carboxamide
CID 97472653
N-benzyl-4-[2-(methylamino)ethyl]piperidine-1-carboxamide
CID 107654135
N-benzyl-4-(2,2-dimethylpropanoyl)piperazine-1-carboxamide
CID 110810660
N,4-dibenzylpiperazine-1-carboxamide;ethane
CID 91343107
3-amino-1-(benzylcarbamoyl)pyrrolidine-3-carboxylic acid
CID 107654401

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4,4-dimethylpiperidine-1-carboxamide?
The IUPAC name of N-benzyl-4,4-dimethylpiperidine-1-carboxamide (CID 110749470) is N-benzyl-4,4-dimethylpiperidine-1-carboxamide.
What is the SMILES notation for N-benzyl-4,4-dimethylpiperidine-1-carboxamide?
The canonical SMILES for N-benzyl-4,4-dimethylpiperidine-1-carboxamide is CC1(C)CCN(C(=O)NCc2ccccc2)CC1.
What is the InChIKey of N-benzyl-4,4-dimethylpiperidine-1-carboxamide?
The InChIKey is QKLAMQVLLLNDTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-15(2)8-10-17(11-9-15)14(18)16-12-13-6-4-3-5-7-13/h3-7H,8-12H2,1-2H3,(H,16,18).
What are the key properties of N-benzyl-4,4-dimethylpiperidine-1-carboxamide?
N-benzyl-4,4-dimethylpiperidine-1-carboxamide has a molecular weight of 246.35 g/mol, XLogP of 3.02, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4,4-dimethylpiperidine-1-carboxamide is sourced from PubChem (CID 110749470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).