N-(1-aminohexan-2-yl)-2-benzylbenzamide

C20H26N2O — CID 119666866

IUPACN-(1-aminohexan-2-yl)-2-benzylbenzamide
SMILESCCCCC(CN)NC(=O)c1ccccc1Cc1ccccc1
InChIInChI=1S/C20H26N2O/c1-2-3-12-18(15-21)22-20(23)19-13-8-7-11-17(19)14-16-9-5-4-6-10-16/h4-11,13,18H,2-3,12,14-15,21H2,1H3,(H,22,23)
InChIKeyXSCUZTDVTTVRKF-UHFFFAOYSA-N
MW310.44 g/mol
LogP3.52
Rot. Bonds8

About N-(1-aminohexan-2-yl)-2-benzylbenzamide

N-(1-aminohexan-2-yl)-2-benzylbenzamide (PubChem CID 119666866) has the molecular formula C20H26N2O and a molecular weight of 310.44 g/mol. Its IUPAC name is N-(1-aminohexan-2-yl)-2-benzylbenzamide.

Molecular Properties

Compound NameN-(1-aminohexan-2-yl)-2-benzylbenzamide
PubChem CID119666866
Molecular FormulaC20H26N2O
Molecular Weight310.44 g/mol
Exact Mass310.20
IUPAC NameN-(1-aminohexan-2-yl)-2-benzylbenzamide
SMILESCCCCC(CN)NC(=O)c1ccccc1Cc1ccccc1
InChIInChI=1S/C20H26N2O/c1-2-3-12-18(15-21)22-20(23)19-13-8-7-11-17(19)14-16-9-5-4-6-10-16/h4-11,13,18H,2-3,12,14-15,21H2,1H3,(H,22,23)
InChIKeyXSCUZTDVTTVRKF-UHFFFAOYSA-N
XLogP3.52
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(1-aminohexan-2-yl)benzamide
CID 122080973
N-(1-aminohexan-2-yl)-2-methylsulfonylbenzamide
CID 119665949
N-[1-(1-aminohexan-2-ylamino)-4-methyl-1-oxopentan-2-yl]-2-methylbenzamide
CID 119667424
N-(1-aminohexan-2-yl)-2-ethylsulfonylbenzamide;hydrochloride
CID 119667537
N-(1-aminohexan-2-yl)-2-(4-fluorobenzoyl)benzamide;hydrochloride
CID 119665027
N-(1-aminohexan-2-yl)-2-(2-methylphenyl)acetamide
CID 80697183
N-(1-aminohexan-2-yl)-3-methyl-2-nitrobenzamide
CID 80696935
N-(1-amino-3-phenylpropan-2-yl)-2-(hydroxymethyl)benzamide
CID 70473357
N-(1-aminopentan-2-yl)-2-phenylacetamide
CID 65191478
N-[1-(1-aminohexan-2-ylamino)-1-oxopropan-2-yl]furan-2-carboxamide
CID 119667471
N-(1-aminohexan-2-yl)-2-(2-benzyl-1,3-thiazol-4-yl)acetamide
CID 119666140
N-[(2R)-1-amino-4-phenylbutan-2-yl]-2-phenylbenzamide
CID 68727278

Frequently Asked Questions

What is the IUPAC name of N-(1-aminohexan-2-yl)-2-benzylbenzamide?
The IUPAC name of N-(1-aminohexan-2-yl)-2-benzylbenzamide (CID 119666866) is N-(1-aminohexan-2-yl)-2-benzylbenzamide.
What is the SMILES notation for N-(1-aminohexan-2-yl)-2-benzylbenzamide?
The canonical SMILES for N-(1-aminohexan-2-yl)-2-benzylbenzamide is CCCCC(CN)NC(=O)c1ccccc1Cc1ccccc1.
What is the InChIKey of N-(1-aminohexan-2-yl)-2-benzylbenzamide?
The InChIKey is XSCUZTDVTTVRKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O/c1-2-3-12-18(15-21)22-20(23)19-13-8-7-11-17(19)14-16-9-5-4-6-10-16/h4-11,13,18H,2-3,12,14-15,21H2,1H3,(H,22,23).
What are the key properties of N-(1-aminohexan-2-yl)-2-benzylbenzamide?
N-(1-aminohexan-2-yl)-2-benzylbenzamide has a molecular weight of 310.44 g/mol, XLogP of 3.52, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminohexan-2-yl)-2-benzylbenzamide is sourced from PubChem (CID 119666866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).