(2R)-2-(3-methylanilino)-N-(2-propan-2-ylphenyl)propanamide

C19H24N2O — CID 39415589

IUPAC(2R)-2-(3-methylanilino)-N-(2-propan-2-ylphenyl)propanamide
SMILESCc1cccc(N[C@H](C)C(=O)Nc2ccccc2C(C)C)c1
InChIInChI=1S/C19H24N2O/c1-13(2)17-10-5-6-11-18(17)21-19(22)15(4)20-16-9-7-8-14(3)12-16/h5-13,15,20H,1-4H3,(H,21,22)/t15-/m1/s1
InChIKeyIWVRIMAKDDSTFV-OAHLLOKOSA-N
MW296.41 g/mol
LogP4.56
Rot. Bonds5

About (2R)-2-(3-methylanilino)-N-(2-propan-2-ylphenyl)propanamide

(2R)-2-(3-methylanilino)-N-(2-propan-2-ylphenyl)propanamide (PubChem CID 39415589) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is (2R)-2-(3-methylanilino)-N-(2-propan-2-ylphenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-(3-methylanilino)-N-(2-propan-2-ylphenyl)propanamide
PubChem CID39415589
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC Name(2R)-2-(3-methylanilino)-N-(2-propan-2-ylphenyl)propanamide
SMILESCc1cccc(N[C@H](C)C(=O)Nc2ccccc2C(C)C)c1
InChIInChI=1S/C19H24N2O/c1-13(2)17-10-5-6-11-18(17)21-19(22)15(4)20-16-9-7-8-14(3)12-16/h5-13,15,20H,1-4H3,(H,21,22)/t15-/m1/s1
InChIKeyIWVRIMAKDDSTFV-OAHLLOKOSA-N
XLogP4.56
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 54.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethoxyphenyl)-2-(3-methylanilino)propanamide
CID 51242335
N-(2,4-dimethylphenyl)-2-(3-methylanilino)propanamide
CID 46757367
(2R)-2-(3-nitroanilino)-N-(2-propan-2-ylphenyl)propanamide
CID 9274223
2,2-dimethyl-N-(3-methylphenyl)-N'-(2-propan-2-ylphenyl)propanediamide
CID 108967343
(2R)-2-(3-bromoanilino)-N-(3-methylphenyl)propanamide
CID 2464663
(2S)-N-(4-methylphenyl)-2-(2-propan-2-ylanilino)propanamide
CID 7986637
N-(3-methylphenyl)-2-[2-oxo-2-(2-propan-2-ylanilino)ethyl]sulfanylacetamide
CID 7731424
(2R)-2-(3-methylphenoxy)-N-(2-propan-2-ylphenyl)propanamide
CID 841227
2-(2,3-dimethylanilino)-N-(3-methylphenyl)propanamide
CID 46757400
(2S)-2-(3-acetamidoanilino)-N-(2-methylphenyl)propanamide
CID 25354903
(2S)-2-(3-methylanilino)propanoic acid
CID 7148356
2-(4-fluoroanilino)-N-(3-methylphenyl)propanamide
CID 46757746

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(3-methylanilino)-N-(2-propan-2-ylphenyl)propanamide?
The IUPAC name of (2R)-2-(3-methylanilino)-N-(2-propan-2-ylphenyl)propanamide (CID 39415589) is (2R)-2-(3-methylanilino)-N-(2-propan-2-ylphenyl)propanamide.
What is the SMILES notation for (2R)-2-(3-methylanilino)-N-(2-propan-2-ylphenyl)propanamide?
The canonical SMILES for (2R)-2-(3-methylanilino)-N-(2-propan-2-ylphenyl)propanamide is Cc1cccc(N[C@H](C)C(=O)Nc2ccccc2C(C)C)c1.
What is the InChIKey of (2R)-2-(3-methylanilino)-N-(2-propan-2-ylphenyl)propanamide?
The InChIKey is IWVRIMAKDDSTFV-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H24N2O/c1-13(2)17-10-5-6-11-18(17)21-19(22)15(4)20-16-9-7-8-14(3)12-16/h5-13,15,20H,1-4H3,(H,21,22)/t15-/m1/s1.
What are the key properties of (2R)-2-(3-methylanilino)-N-(2-propan-2-ylphenyl)propanamide?
(2R)-2-(3-methylanilino)-N-(2-propan-2-ylphenyl)propanamide has a molecular weight of 296.41 g/mol, XLogP of 4.56, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(3-methylanilino)-N-(2-propan-2-ylphenyl)propanamide is sourced from PubChem (CID 39415589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).