N-(2-amino-1-phenylethyl)naphthalene-1-carboxamide

C19H18N2O — CID 10424319

IUPACN-(2-amino-1-phenylethyl)naphthalene-1-carboxamide
SMILESNCC(NC(=O)c1cccc2ccccc12)c1ccccc1
InChIInChI=1S/C19H18N2O/c20-13-18(15-8-2-1-3-9-15)21-19(22)17-12-6-10-14-7-4-5-11-16(14)17/h1-12,18H,13,20H2,(H,21,22)
InChIKeyVGVYJIHZJKJRMJ-UHFFFAOYSA-N
MW290.37 g/mol
LogP3.27
Rot. Bonds4

About N-(2-amino-1-phenylethyl)naphthalene-1-carboxamide

N-(2-amino-1-phenylethyl)naphthalene-1-carboxamide (PubChem CID 10424319) has the molecular formula C19H18N2O and a molecular weight of 290.37 g/mol. Its IUPAC name is N-(2-amino-1-phenylethyl)naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-(2-amino-1-phenylethyl)naphthalene-1-carboxamide
PubChem CID10424319
Molecular FormulaC19H18N2O
Molecular Weight290.37 g/mol
Exact Mass290.14
IUPAC NameN-(2-amino-1-phenylethyl)naphthalene-1-carboxamide
SMILESNCC(NC(=O)c1cccc2ccccc12)c1ccccc1
InChIInChI=1S/C19H18N2O/c20-13-18(15-8-2-1-3-9-15)21-19(22)17-12-6-10-14-7-4-5-11-16(14)17/h1-12,18H,13,20H2,(H,21,22)
InChIKeyVGVYJIHZJKJRMJ-UHFFFAOYSA-N
XLogP3.27
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-1-phenylethyl)-2-hydroxybenzamide
CID 55242924
N-(2-amino-1-phenylethyl)-2-hydroxy-3-methoxybenzamide
CID 63753586
(2-amino-1-phenylethyl)carbamic acid
CID 66600321
N-(2-amino-1-phenylethyl)-2,5-dihydroxybenzamide
CID 107726326
N-(2-amino-1-cyclopropylethyl)naphthalene-1-carboxamide
CID 65188485
N-(1-aminopentan-2-yl)naphthalene-1-carboxamide
CID 65191426
(2S)-2-(naphthalene-1-carbonylamino)propanoic acid
CID 11637328
N-(2-amino-1-phenylethyl)-4-hydroxy-2-methylbenzamide
CID 107673314
N-(2-amino-1-phenylethyl)-1-oxidoquinolin-1-ium-2-carboxamide
CID 11722744
N-(1-amino-4,4-dimethylpentan-3-yl)naphthalene-1-carboxamide
CID 106357235
1-bromo-N-[(1S)-2-hydroxy-1-phenylethyl]naphthalene-2-carboxamide
CID 10044629
N-(1-naphthalen-1-ylethyl)naphthalene-1-carboxamide
CID 593320

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-phenylethyl)naphthalene-1-carboxamide?
The IUPAC name of N-(2-amino-1-phenylethyl)naphthalene-1-carboxamide (CID 10424319) is N-(2-amino-1-phenylethyl)naphthalene-1-carboxamide.
What is the SMILES notation for N-(2-amino-1-phenylethyl)naphthalene-1-carboxamide?
The canonical SMILES for N-(2-amino-1-phenylethyl)naphthalene-1-carboxamide is NCC(NC(=O)c1cccc2ccccc12)c1ccccc1.
What is the InChIKey of N-(2-amino-1-phenylethyl)naphthalene-1-carboxamide?
The InChIKey is VGVYJIHZJKJRMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O/c20-13-18(15-8-2-1-3-9-15)21-19(22)17-12-6-10-14-7-4-5-11-16(14)17/h1-12,18H,13,20H2,(H,21,22).
What are the key properties of N-(2-amino-1-phenylethyl)naphthalene-1-carboxamide?
N-(2-amino-1-phenylethyl)naphthalene-1-carboxamide has a molecular weight of 290.37 g/mol, XLogP of 3.27, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-phenylethyl)naphthalene-1-carboxamide is sourced from PubChem (CID 10424319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).