2-methyl-3-(propan-2-ylamino)benzamide

C11H16N2O — CID 43694179

IUPAC2-methyl-3-(propan-2-ylamino)benzamide
SMILESCc1c(NC(C)C)cccc1C(N)=O
InChIInChI=1S/C11H16N2O/c1-7(2)13-10-6-4-5-9(8(10)3)11(12)14/h4-7,13H,1-3H3,(H2,12,14)
InChIKeyGGNNSXDTQFNGCT-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.91
Rot. Bonds3

About 2-methyl-3-(propan-2-ylamino)benzamide

2-methyl-3-(propan-2-ylamino)benzamide (PubChem CID 43694179) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-methyl-3-(propan-2-ylamino)benzamide.

Molecular Properties

Compound Name2-methyl-3-(propan-2-ylamino)benzamide
PubChem CID43694179
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-methyl-3-(propan-2-ylamino)benzamide
SMILESCc1c(NC(C)C)cccc1C(N)=O
InChIInChI=1S/C11H16N2O/c1-7(2)13-10-6-4-5-9(8(10)3)11(12)14/h4-7,13H,1-3H3,(H2,12,14)
InChIKeyGGNNSXDTQFNGCT-UHFFFAOYSA-N
XLogP1.91
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 115928848
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3-[1-(2,4-dibromophenyl)ethylamino]-2-methylbenzamide
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4-(3-carbamoyl-2-methylanilino)-2,3-dimethyl-4-oxobutanoic acid
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CID 107714808
3-[(4-amino-3-methylbutanoyl)amino]-2-methylbenzamide
CID 81075423
(2-amino-2-oxoethyl) 2-methyl-3-[[(2R)-3-methylbutan-2-yl]amino]benzoate
CID 95636343
3-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-2-methylbenzamide
CID 61180394
3-[(2-chloroacetyl)amino]-2-methylbenzamide
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N-(3-carbamoyl-2-methylphenyl)-1-(2-methylpropanoyl)pyrrolidine-2-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(propan-2-ylamino)benzamide?
The IUPAC name of 2-methyl-3-(propan-2-ylamino)benzamide (CID 43694179) is 2-methyl-3-(propan-2-ylamino)benzamide.
What is the SMILES notation for 2-methyl-3-(propan-2-ylamino)benzamide?
The canonical SMILES for 2-methyl-3-(propan-2-ylamino)benzamide is Cc1c(NC(C)C)cccc1C(N)=O.
What is the InChIKey of 2-methyl-3-(propan-2-ylamino)benzamide?
The InChIKey is GGNNSXDTQFNGCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-7(2)13-10-6-4-5-9(8(10)3)11(12)14/h4-7,13H,1-3H3,(H2,12,14).
What are the key properties of 2-methyl-3-(propan-2-ylamino)benzamide?
2-methyl-3-(propan-2-ylamino)benzamide has a molecular weight of 192.26 g/mol, XLogP of 1.91, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(propan-2-ylamino)benzamide is sourced from PubChem (CID 43694179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).