2-[[(1R)-1-(2-methylphenyl)ethyl]amino]propanamide

C12H18N2O — CID 81375516

IUPAC2-[[(1R)-1-(2-methylphenyl)ethyl]amino]propanamide
SMILESCc1ccccc1[C@@H](C)NC(C)C(N)=O
InChIInChI=1S/C12H18N2O/c1-8-6-4-5-7-11(8)9(2)14-10(3)12(13)15/h4-7,9-10,14H,1-3H3,(H2,13,15)/t9-,10?/m1/s1
InChIKeyUBVYDDPDYORZPM-YHMJZVADSA-N
MW206.29 g/mol
LogP1.52
Rot. Bonds4

About 2-[[(1R)-1-(2-methylphenyl)ethyl]amino]propanamide

2-[[(1R)-1-(2-methylphenyl)ethyl]amino]propanamide (PubChem CID 81375516) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-[[(1R)-1-(2-methylphenyl)ethyl]amino]propanamide.

Molecular Properties

Compound Name2-[[(1R)-1-(2-methylphenyl)ethyl]amino]propanamide
PubChem CID81375516
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name2-[[(1R)-1-(2-methylphenyl)ethyl]amino]propanamide
SMILESCc1ccccc1[C@@H](C)NC(C)C(N)=O
InChIInChI=1S/C12H18N2O/c1-8-6-4-5-7-11(8)9(2)14-10(3)12(13)15/h4-7,9-10,14H,1-3H3,(H2,13,15)/t9-,10?/m1/s1
InChIKeyUBVYDDPDYORZPM-YHMJZVADSA-N
XLogP1.52
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[[(1R)-1-(2-methylphenyl)ethyl]amino]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-carbamoyl-2-[[(1R)-1-(2-methylphenyl)ethyl]amino]propanamide
CID 81374015
2-[[(1R)-1-(2-methylphenyl)ethyl]amino]butanamide
CID 81375406
2-amino-3-[1-(2-methylphenyl)ethylamino]propanamide
CID 103246227
2-[[(1R)-1-(2-methylphenyl)ethyl]amino]-N-pentan-2-ylpropanamide
CID 81374940
2-(2-methylphenyl)propanamide;dihydrochloride
CID 162317897
2-[1-(4-chloronaphthalen-1-yl)ethylamino]propanamide
CID 167984225
2-[1-(2,6-dihydroxyphenyl)ethylamino]propanamide
CID 107710565
methyl 2-[[(1R)-1-(2-methoxyphenyl)ethyl]amino]propanoate
CID 81396743
2-[1-(4-phenylphenyl)ethylamino]propanamide
CID 43398020
4-N-[1-(2-methylphenyl)ethyl]benzene-1,4-dicarboxamide
CID 51175514
2-bromo-2-(2-methylphenyl)acetamide
CID 19981756
1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[1-(2-methylphenyl)ethylamino]propan-1-one
CID 18097377

Frequently Asked Questions

What is the IUPAC name of 2-[[(1R)-1-(2-methylphenyl)ethyl]amino]propanamide?
The IUPAC name of 2-[[(1R)-1-(2-methylphenyl)ethyl]amino]propanamide (CID 81375516) is 2-[[(1R)-1-(2-methylphenyl)ethyl]amino]propanamide.
What is the SMILES notation for 2-[[(1R)-1-(2-methylphenyl)ethyl]amino]propanamide?
The canonical SMILES for 2-[[(1R)-1-(2-methylphenyl)ethyl]amino]propanamide is Cc1ccccc1[C@@H](C)NC(C)C(N)=O.
What is the InChIKey of 2-[[(1R)-1-(2-methylphenyl)ethyl]amino]propanamide?
The InChIKey is UBVYDDPDYORZPM-YHMJZVADSA-N. The full InChI is InChI=1S/C12H18N2O/c1-8-6-4-5-7-11(8)9(2)14-10(3)12(13)15/h4-7,9-10,14H,1-3H3,(H2,13,15)/t9-,10?/m1/s1.
What are the key properties of 2-[[(1R)-1-(2-methylphenyl)ethyl]amino]propanamide?
2-[[(1R)-1-(2-methylphenyl)ethyl]amino]propanamide has a molecular weight of 206.29 g/mol, XLogP of 1.52, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(1R)-1-(2-methylphenyl)ethyl]amino]propanamide is sourced from PubChem (CID 81375516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).