2-amino-6-methyl-N-[1-(2-methylphenyl)ethyl]benzamide

C17H20N2O — CID 61118569

IUPAC2-amino-6-methyl-N-[1-(2-methylphenyl)ethyl]benzamide
SMILESCc1ccccc1C(C)NC(=O)c1c(C)cccc1N
InChIInChI=1S/C17H20N2O/c1-11-7-4-5-9-14(11)13(3)19-17(20)16-12(2)8-6-10-15(16)18/h4-10,13H,18H2,1-3H3,(H,19,20)
InChIKeyRZQDRFJYYMAMHD-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.38
Rot. Bonds3

About 2-amino-6-methyl-N-[1-(2-methylphenyl)ethyl]benzamide

2-amino-6-methyl-N-[1-(2-methylphenyl)ethyl]benzamide (PubChem CID 61118569) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-amino-6-methyl-N-[1-(2-methylphenyl)ethyl]benzamide.

Molecular Properties

Compound Name2-amino-6-methyl-N-[1-(2-methylphenyl)ethyl]benzamide
PubChem CID61118569
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name2-amino-6-methyl-N-[1-(2-methylphenyl)ethyl]benzamide
SMILESCc1ccccc1C(C)NC(=O)c1c(C)cccc1N
InChIInChI=1S/C17H20N2O/c1-11-7-4-5-9-14(11)13(3)19-17(20)16-12(2)8-6-10-15(16)18/h4-10,13H,18H2,1-3H3,(H,19,20)
InChIKeyRZQDRFJYYMAMHD-UHFFFAOYSA-N
XLogP3.38
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.38
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

2-amino-6-chloro-N-[1-(2-methylphenyl)ethyl]benzamide
CID 63659319
2-amino-6-methoxy-N-[1-(2-methylphenyl)ethyl]benzamide
CID 81394137
2-amino-N-[(2S)-1-hydroxypropan-2-yl]-6-methylbenzamide
CID 93081123
2-amino-N-[(2R)-1-hydroxypropan-2-yl]-6-methylbenzamide
CID 93081124
4-amino-5-methyl-N-[1-(2-methylphenyl)ethyl]thiophene-2-carboxamide
CID 61118574
methyl 2-[(2-amino-6-methylbenzoyl)amino]-3-methylbutanoate
CID 43451998
2-amino-N-(4-hydroxy-3-methylbutan-2-yl)-6-methylbenzamide
CID 113484642
2-amino-6-methyl-N-(4-phenylbutan-2-yl)benzamide
CID 61112835
4-N-[1-(2-methylphenyl)ethyl]benzene-1,4-dicarboxamide
CID 51175514
2-amino-N-(2-hydroxy-1-phenylethyl)-6-methylbenzamide
CID 63184679
3,5-dimethyl-N-[1-(2-methylphenyl)ethyl]-1,2-oxazole-4-carboxamide
CID 18082542
3-amino-2,5-difluoro-N-[1-(2-methylphenyl)ethyl]benzamide
CID 107120653

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-methyl-N-[1-(2-methylphenyl)ethyl]benzamide?
The IUPAC name of 2-amino-6-methyl-N-[1-(2-methylphenyl)ethyl]benzamide (CID 61118569) is 2-amino-6-methyl-N-[1-(2-methylphenyl)ethyl]benzamide.
What is the SMILES notation for 2-amino-6-methyl-N-[1-(2-methylphenyl)ethyl]benzamide?
The canonical SMILES for 2-amino-6-methyl-N-[1-(2-methylphenyl)ethyl]benzamide is Cc1ccccc1C(C)NC(=O)c1c(C)cccc1N.
What is the InChIKey of 2-amino-6-methyl-N-[1-(2-methylphenyl)ethyl]benzamide?
The InChIKey is RZQDRFJYYMAMHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-11-7-4-5-9-14(11)13(3)19-17(20)16-12(2)8-6-10-15(16)18/h4-10,13H,18H2,1-3H3,(H,19,20).
What are the key properties of 2-amino-6-methyl-N-[1-(2-methylphenyl)ethyl]benzamide?
2-amino-6-methyl-N-[1-(2-methylphenyl)ethyl]benzamide has a molecular weight of 268.36 g/mol, XLogP of 3.38, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-methyl-N-[1-(2-methylphenyl)ethyl]benzamide is sourced from PubChem (CID 61118569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).