2-(ethylamino)-N-[(1R)-1-(3-methylphenyl)ethyl]benzamide

C18H22N2O — CID 81368098

IUPAC2-(ethylamino)-N-[(1R)-1-(3-methylphenyl)ethyl]benzamide
SMILESCCNc1ccccc1C(=O)N[C@H](C)c1cccc(C)c1
InChIInChI=1S/C18H22N2O/c1-4-19-17-11-6-5-10-16(17)18(21)20-14(3)15-9-7-8-13(2)12-15/h5-12,14,19H,4H2,1-3H3,(H,20,21)/t14-/m1/s1
InChIKeyFCFBQUHTFCFFJN-CQSZACIVSA-N
MW282.39 g/mol
LogP3.92
Rot. Bonds5

About 2-(ethylamino)-N-[(1R)-1-(3-methylphenyl)ethyl]benzamide

2-(ethylamino)-N-[(1R)-1-(3-methylphenyl)ethyl]benzamide (PubChem CID 81368098) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is 2-(ethylamino)-N-[(1R)-1-(3-methylphenyl)ethyl]benzamide.

Molecular Properties

Compound Name2-(ethylamino)-N-[(1R)-1-(3-methylphenyl)ethyl]benzamide
PubChem CID81368098
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name2-(ethylamino)-N-[(1R)-1-(3-methylphenyl)ethyl]benzamide
SMILESCCNc1ccccc1C(=O)N[C@H](C)c1cccc(C)c1
InChIInChI=1S/C18H22N2O/c1-4-19-17-11-6-5-10-16(17)18(21)20-14(3)15-9-7-8-13(2)12-15/h5-12,14,19H,4H2,1-3H3,(H,20,21)/t14-/m1/s1
InChIKeyFCFBQUHTFCFFJN-CQSZACIVSA-N
XLogP3.92
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1S)-1-(3-bromophenyl)ethyl]-2-(ethylamino)benzamide
CID 81381793
N-[(1S)-1-(4-chlorophenyl)ethyl]-2-(ethylamino)benzamide
CID 81356651
2-[[(1R)-1-(3-methylphenyl)ethyl]carbamoyl]benzoic acid
CID 81369000
2-(ethylamino)-N-(1-thiophen-3-ylethyl)benzamide
CID 55127001
2-(ethylamino)-N-[1-(furan-2-yl)ethyl]benzamide
CID 62169362
ethyl 2-[[2-(ethylamino)benzoyl]amino]propanoate
CID 63108435
2-(ethylamino)-N-(1-pyridin-2-ylethyl)benzamide
CID 62168319
N-but-3-yn-2-yl-2-(ethylamino)benzamide
CID 114418246
methyl (2S)-2-[[2-(ethylamino)benzoyl]amino]propanoate
CID 63107958
2-(ethylamino)-N-(2-phenylpropyl)benzamide
CID 63107799
methyl 2-[[2-(ethylamino)benzoyl]amino]-3-methylpentanoate
CID 63107982
2,4-dimethyl-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]benzamide
CID 26242918

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-[(1R)-1-(3-methylphenyl)ethyl]benzamide?
The IUPAC name of 2-(ethylamino)-N-[(1R)-1-(3-methylphenyl)ethyl]benzamide (CID 81368098) is 2-(ethylamino)-N-[(1R)-1-(3-methylphenyl)ethyl]benzamide.
What is the SMILES notation for 2-(ethylamino)-N-[(1R)-1-(3-methylphenyl)ethyl]benzamide?
The canonical SMILES for 2-(ethylamino)-N-[(1R)-1-(3-methylphenyl)ethyl]benzamide is CCNc1ccccc1C(=O)N[C@H](C)c1cccc(C)c1.
What is the InChIKey of 2-(ethylamino)-N-[(1R)-1-(3-methylphenyl)ethyl]benzamide?
The InChIKey is FCFBQUHTFCFFJN-CQSZACIVSA-N. The full InChI is InChI=1S/C18H22N2O/c1-4-19-17-11-6-5-10-16(17)18(21)20-14(3)15-9-7-8-13(2)12-15/h5-12,14,19H,4H2,1-3H3,(H,20,21)/t14-/m1/s1.
What are the key properties of 2-(ethylamino)-N-[(1R)-1-(3-methylphenyl)ethyl]benzamide?
2-(ethylamino)-N-[(1R)-1-(3-methylphenyl)ethyl]benzamide has a molecular weight of 282.39 g/mol, XLogP of 3.92, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-[(1R)-1-(3-methylphenyl)ethyl]benzamide is sourced from PubChem (CID 81368098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).