2-amino-N-[(1R)-1-naphthalen-1-ylethyl]benzamide

C19H18N2O — CID 131858457

IUPAC2-amino-N-[(1R)-1-naphthalen-1-ylethyl]benzamide
SMILESC[C@@H](NC(=O)c1ccccc1N)c1cccc2ccccc12
InChIInChI=1S/C19H18N2O/c1-13(21-19(22)17-10-4-5-12-18(17)20)15-11-6-8-14-7-2-3-9-16(14)15/h2-13H,20H2,1H3,(H,21,22)/t13-/m1/s1
InChIKeyXBKSQQRARUIWNW-CYBMUJFWSA-N
MW290.37 g/mol
LogP3.91
Rot. Bonds3

About 2-amino-N-[(1R)-1-naphthalen-1-ylethyl]benzamide

2-amino-N-[(1R)-1-naphthalen-1-ylethyl]benzamide (PubChem CID 131858457) has the molecular formula C19H18N2O and a molecular weight of 290.37 g/mol. Its IUPAC name is 2-amino-N-[(1R)-1-naphthalen-1-ylethyl]benzamide.

Molecular Properties

Compound Name2-amino-N-[(1R)-1-naphthalen-1-ylethyl]benzamide
PubChem CID131858457
Molecular FormulaC19H18N2O
Molecular Weight290.37 g/mol
Exact Mass290.14
IUPAC Name2-amino-N-[(1R)-1-naphthalen-1-ylethyl]benzamide
SMILESC[C@@H](NC(=O)c1ccccc1N)c1cccc2ccccc12
InChIInChI=1S/C19H18N2O/c1-13(21-19(22)17-10-4-5-12-18(17)20)15-11-6-8-14-7-2-3-9-16(14)15/h2-13H,20H2,1H3,(H,21,22)/t13-/m1/s1
InChIKeyXBKSQQRARUIWNW-CYBMUJFWSA-N
XLogP3.91
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(1-naphthalen-1-ylethyl)naphthalene-1-carboxamide
CID 593320
2-[[(1R)-1-naphthalen-1-ylethyl]carbamoyl]benzoic acid
CID 853685
2-(2-aminoethyl)-N-(1-naphthalen-1-ylethyl)benzamide;hydrochloride
CID 170337610
2-ethylsulfanyl-N-(1-naphthalen-1-ylethyl)benzamide
CID 24624533
N'-(1-naphthalen-1-ylethyl)-N-[(1S)-1-naphthalen-1-ylethyl]oxamide
CID 90809930
5-amino-2-(ethylamino)-N-[(1R)-1-naphthalen-1-ylethyl]benzamide
CID 163231886
2-[2-(1-naphthalen-1-ylethylcarbamoyl)phenyl]ethylcarbamic acid
CID 170337732
N-(1-naphthalen-1-ylethyl)propanamide
CID 13202765
5-methyl-N-[(1R)-1-naphthalen-1-ylethyl]thiophene-2-carboxamide
CID 27753913
2-(cyclopropanecarbonylamino)-N-[(1S)-1-naphthalen-1-ylethyl]benzamide
CID 167794265
2-methyl-N-[(1R)-1-naphthalen-1-ylethyl]-5-phenylbenzamide
CID 165115788
2-bromo-3-methyl-N-(1-naphthalen-1-ylethyl)butanamide
CID 43346795

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(1R)-1-naphthalen-1-ylethyl]benzamide?
The IUPAC name of 2-amino-N-[(1R)-1-naphthalen-1-ylethyl]benzamide (CID 131858457) is 2-amino-N-[(1R)-1-naphthalen-1-ylethyl]benzamide.
What is the SMILES notation for 2-amino-N-[(1R)-1-naphthalen-1-ylethyl]benzamide?
The canonical SMILES for 2-amino-N-[(1R)-1-naphthalen-1-ylethyl]benzamide is C[C@@H](NC(=O)c1ccccc1N)c1cccc2ccccc12.
What is the InChIKey of 2-amino-N-[(1R)-1-naphthalen-1-ylethyl]benzamide?
The InChIKey is XBKSQQRARUIWNW-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H18N2O/c1-13(21-19(22)17-10-4-5-12-18(17)20)15-11-6-8-14-7-2-3-9-16(14)15/h2-13H,20H2,1H3,(H,21,22)/t13-/m1/s1.
What are the key properties of 2-amino-N-[(1R)-1-naphthalen-1-ylethyl]benzamide?
2-amino-N-[(1R)-1-naphthalen-1-ylethyl]benzamide has a molecular weight of 290.37 g/mol, XLogP of 3.91, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(1R)-1-naphthalen-1-ylethyl]benzamide is sourced from PubChem (CID 131858457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).