N-cycloheptyl-4-(methylamino)benzamide

C15H22N2O — CID 62165627

IUPACN-cycloheptyl-4-(methylamino)benzamide
SMILESCNc1ccc(C(=O)NC2CCCCCC2)cc1
InChIInChI=1S/C15H22N2O/c1-16-13-10-8-12(9-11-13)15(18)17-14-6-4-2-3-5-7-14/h8-11,14,16H,2-7H2,1H3,(H,17,18)
InChIKeyUXBCKLMTIOMLFM-UHFFFAOYSA-N
MW246.35 g/mol
LogP3.18
Rot. Bonds3

About N-cycloheptyl-4-(methylamino)benzamide

N-cycloheptyl-4-(methylamino)benzamide (PubChem CID 62165627) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-cycloheptyl-4-(methylamino)benzamide.

Molecular Properties

Compound NameN-cycloheptyl-4-(methylamino)benzamide
PubChem CID62165627
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-cycloheptyl-4-(methylamino)benzamide
SMILESCNc1ccc(C(=O)NC2CCCCCC2)cc1
InChIInChI=1S/C15H22N2O/c1-16-13-10-8-12(9-11-13)15(18)17-14-6-4-2-3-5-7-14/h8-11,14,16H,2-7H2,1H3,(H,17,18)
InChIKeyUXBCKLMTIOMLFM-UHFFFAOYSA-N
XLogP3.18
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-4-(methylamino)benzamide
CID 62170956
4-acetamido-N-cyclooctylbenzamide
CID 2990044
N-cyclooctyl-4-methylbenzamide
CID 3995245
N-(4-ethylcyclohexyl)-4-(methylamino)benzamide
CID 62179103
N-cyclooctyl-4-(propylamino)benzamide
CID 62172072
N-(2-hydroxycyclohexyl)-4-(methylamino)benzamide
CID 62360968
N-cyclohexyl-4-(propanoylamino)benzamide
CID 977209
N-cyclooctyl-4-(2-methylpropanoylamino)benzamide
CID 3901295
4-bromo-N-cyclooctylbenzamide
CID 902872
4-bromo-N-cycloheptylbenzamide
CID 2843132
N-cyclohexyl-4-methylsulfanylbenzamide
CID 60645846
1-N-cyclohexyl-4-N-(4-propan-2-ylphenyl)benzene-1,4-dicarboxamide
CID 109044795

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-4-(methylamino)benzamide?
The IUPAC name of N-cycloheptyl-4-(methylamino)benzamide (CID 62165627) is N-cycloheptyl-4-(methylamino)benzamide.
What is the SMILES notation for N-cycloheptyl-4-(methylamino)benzamide?
The canonical SMILES for N-cycloheptyl-4-(methylamino)benzamide is CNc1ccc(C(=O)NC2CCCCCC2)cc1.
What is the InChIKey of N-cycloheptyl-4-(methylamino)benzamide?
The InChIKey is UXBCKLMTIOMLFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-16-13-10-8-12(9-11-13)15(18)17-14-6-4-2-3-5-7-14/h8-11,14,16H,2-7H2,1H3,(H,17,18).
What are the key properties of N-cycloheptyl-4-(methylamino)benzamide?
N-cycloheptyl-4-(methylamino)benzamide has a molecular weight of 246.35 g/mol, XLogP of 3.18, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-4-(methylamino)benzamide is sourced from PubChem (CID 62165627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).