N-cycloheptyl-N,2-dimethylpiperidine-2-carboxamide

C15H28N2O — CID 104596167

IUPACN-cycloheptyl-N,2-dimethylpiperidine-2-carboxamide
SMILESCN(C(=O)C1(C)CCCCN1)C1CCCCCC1
InChIInChI=1S/C15H28N2O/c1-15(11-7-8-12-16-15)14(18)17(2)13-9-5-3-4-6-10-13/h13,16H,3-12H2,1-2H3
InChIKeyHLFYGMSDGAHSPH-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.70
Rot. Bonds2

About N-cycloheptyl-N,2-dimethylpiperidine-2-carboxamide

N-cycloheptyl-N,2-dimethylpiperidine-2-carboxamide (PubChem CID 104596167) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is N-cycloheptyl-N,2-dimethylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-N,2-dimethylpiperidine-2-carboxamide
PubChem CID104596167
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC NameN-cycloheptyl-N,2-dimethylpiperidine-2-carboxamide
SMILESCN(C(=O)C1(C)CCCCN1)C1CCCCCC1
InChIInChI=1S/C15H28N2O/c1-15(11-7-8-12-16-15)14(18)17(2)13-9-5-3-4-6-10-13/h13,16H,3-12H2,1-2H3
InChIKeyHLFYGMSDGAHSPH-UHFFFAOYSA-N
XLogP2.70
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-N,2-dimethylpiperidine-2-carboxamide?
The IUPAC name of N-cycloheptyl-N,2-dimethylpiperidine-2-carboxamide (CID 104596167) is N-cycloheptyl-N,2-dimethylpiperidine-2-carboxamide.
What is the SMILES notation for N-cycloheptyl-N,2-dimethylpiperidine-2-carboxamide?
The canonical SMILES for N-cycloheptyl-N,2-dimethylpiperidine-2-carboxamide is CN(C(=O)C1(C)CCCCN1)C1CCCCCC1.
What is the InChIKey of N-cycloheptyl-N,2-dimethylpiperidine-2-carboxamide?
The InChIKey is HLFYGMSDGAHSPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-15(11-7-8-12-16-15)14(18)17(2)13-9-5-3-4-6-10-13/h13,16H,3-12H2,1-2H3.
What are the key properties of N-cycloheptyl-N,2-dimethylpiperidine-2-carboxamide?
N-cycloheptyl-N,2-dimethylpiperidine-2-carboxamide has a molecular weight of 252.40 g/mol, XLogP of 2.70, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-N,2-dimethylpiperidine-2-carboxamide is sourced from PubChem (CID 104596167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).