N-(cyclohexylmethyl)-2-[2-(methylamino)ethyl]benzamide

C17H26N2O — CID 104547420

IUPACN-(cyclohexylmethyl)-2-[2-(methylamino)ethyl]benzamide
SMILESCNCCc1ccccc1C(=O)NCC1CCCCC1
InChIInChI=1S/C17H26N2O/c1-18-12-11-15-9-5-6-10-16(15)17(20)19-13-14-7-3-2-4-8-14/h5-6,9-10,14,18H,2-4,7-8,11-13H2,1H3,(H,19,20)
InChIKeySGGRKONUZSDUAQ-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.76
Rot. Bonds6

About N-(cyclohexylmethyl)-2-[2-(methylamino)ethyl]benzamide

N-(cyclohexylmethyl)-2-[2-(methylamino)ethyl]benzamide (PubChem CID 104547420) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-2-[2-(methylamino)ethyl]benzamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-2-[2-(methylamino)ethyl]benzamide
PubChem CID104547420
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-(cyclohexylmethyl)-2-[2-(methylamino)ethyl]benzamide
SMILESCNCCc1ccccc1C(=O)NCC1CCCCC1
InChIInChI=1S/C17H26N2O/c1-18-12-11-15-9-5-6-10-16(15)17(20)19-13-14-7-3-2-4-8-14/h5-6,9-10,14,18H,2-4,7-8,11-13H2,1H3,(H,19,20)
InChIKeySGGRKONUZSDUAQ-UHFFFAOYSA-N
XLogP2.76
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,2-dicyclopropylethyl)-2-[2-(methylamino)ethyl]benzamide
CID 104548036
N-(2-methoxy-2-methylpropyl)-2-[2-(methylamino)ethyl]benzamide
CID 104761286
2-amino-N-(cyclohexylmethyl)benzamide
CID 43215482
N-(cyclohexylmethyl)-2-iodobenzamide
CID 2677280
2-[2-(methylamino)ethyl]-N-[2-(oxolan-2-yl)ethyl]benzamide
CID 104547635
2-[2-(methylamino)ethyl]benzohydrazide
CID 104547939
3-[[2-[2-(methylamino)ethyl]benzoyl]amino]propanoic acid
CID 71070439
2-[2-(methylamino)ethyl]-N-[2-(methylamino)-2-oxoethyl]benzamide
CID 104547416
N-(2-ethoxyethyl)-2-[2-(methylamino)ethyl]benzamide
CID 113425672
N-(cyclohexylmethyl)-2,3-dihydroxybenzamide
CID 56679854
N-(cyclohexylmethyl)-3-hydroxy-2-methylbenzamide
CID 82826551
2-[2-(methylamino)ethyl]-N-prop-2-enylbenzamide
CID 104547357

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-2-[2-(methylamino)ethyl]benzamide?
The IUPAC name of N-(cyclohexylmethyl)-2-[2-(methylamino)ethyl]benzamide (CID 104547420) is N-(cyclohexylmethyl)-2-[2-(methylamino)ethyl]benzamide.
What is the SMILES notation for N-(cyclohexylmethyl)-2-[2-(methylamino)ethyl]benzamide?
The canonical SMILES for N-(cyclohexylmethyl)-2-[2-(methylamino)ethyl]benzamide is CNCCc1ccccc1C(=O)NCC1CCCCC1.
What is the InChIKey of N-(cyclohexylmethyl)-2-[2-(methylamino)ethyl]benzamide?
The InChIKey is SGGRKONUZSDUAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-18-12-11-15-9-5-6-10-16(15)17(20)19-13-14-7-3-2-4-8-14/h5-6,9-10,14,18H,2-4,7-8,11-13H2,1H3,(H,19,20).
What are the key properties of N-(cyclohexylmethyl)-2-[2-(methylamino)ethyl]benzamide?
N-(cyclohexylmethyl)-2-[2-(methylamino)ethyl]benzamide has a molecular weight of 274.41 g/mol, XLogP of 2.76, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-2-[2-(methylamino)ethyl]benzamide is sourced from PubChem (CID 104547420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).