N-methyl-2-[[(1S)-1-phenylethyl]amino]propanamide

C12H18N2O — CID 63866912

IUPACN-methyl-2-[[(1S)-1-phenylethyl]amino]propanamide
SMILESCNC(=O)C(C)N[C@@H](C)c1ccccc1
InChIInChI=1S/C12H18N2O/c1-9(11-7-5-4-6-8-11)14-10(2)12(15)13-3/h4-10,14H,1-3H3,(H,13,15)/t9-,10?/m0/s1
InChIKeyFCMSLBJQNJESFH-RGURZIINSA-N
MW206.29 g/mol
LogP1.47
Rot. Bonds4

About N-methyl-2-[[(1S)-1-phenylethyl]amino]propanamide

N-methyl-2-[[(1S)-1-phenylethyl]amino]propanamide (PubChem CID 63866912) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is N-methyl-2-[[(1S)-1-phenylethyl]amino]propanamide.

Molecular Properties

Compound NameN-methyl-2-[[(1S)-1-phenylethyl]amino]propanamide
PubChem CID63866912
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC NameN-methyl-2-[[(1S)-1-phenylethyl]amino]propanamide
SMILESCNC(=O)C(C)N[C@@H](C)c1ccccc1
InChIInChI=1S/C12H18N2O/c1-9(11-7-5-4-6-8-11)14-10(2)12(15)13-3/h4-10,14H,1-3H3,(H,13,15)/t9-,10?/m0/s1
InChIKeyFCMSLBJQNJESFH-RGURZIINSA-N
XLogP1.47
TPSA41.13 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 ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-methyl-2-[[(1S)-1-phenylethyl]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

(2R)-2-[1-(4-bromophenyl)ethylamino]-N-methylpropanamide
CID 103740453
2-(1-phenylethylamino)propanoic acid;hydrochloride
CID 75479950
N-ethyl-2-[[(1R)-1-phenylethyl]amino]propanamide
CID 78952919
N-methyl-2-[[(1S)-1-pyridin-3-ylethyl]amino]propanamide
CID 81404603
N-cyclopropyl-2-[[(1S)-1-phenylethyl]amino]propanamide
CID 55251616
N-cyclopropyl-2-(1-phenylethylamino)propanamide
CID 43085781
2-[1-(4-ethylphenyl)ethylamino]-N-methylpropanamide
CID 60674323
N-(2-methylpropyl)-2-[[(1S)-1-phenylethyl]amino]propanamide
CID 63705951
N-pentan-2-yl-2-[[(1R)-1-phenylethyl]amino]propanamide
CID 78948251
(2S)-N-(4-methoxyphenyl)-2-[[(1R)-1-phenylethyl]amino]propanamide
CID 9248611
1-phenyl-2-(1-phenylethylamino)propan-1-one;hydrochloride
CID 155432915
(2R)-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-N-methylpropanamide
CID 9410224

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[[(1S)-1-phenylethyl]amino]propanamide?
The IUPAC name of N-methyl-2-[[(1S)-1-phenylethyl]amino]propanamide (CID 63866912) is N-methyl-2-[[(1S)-1-phenylethyl]amino]propanamide.
What is the SMILES notation for N-methyl-2-[[(1S)-1-phenylethyl]amino]propanamide?
The canonical SMILES for N-methyl-2-[[(1S)-1-phenylethyl]amino]propanamide is CNC(=O)C(C)N[C@@H](C)c1ccccc1.
What is the InChIKey of N-methyl-2-[[(1S)-1-phenylethyl]amino]propanamide?
The InChIKey is FCMSLBJQNJESFH-RGURZIINSA-N. The full InChI is InChI=1S/C12H18N2O/c1-9(11-7-5-4-6-8-11)14-10(2)12(15)13-3/h4-10,14H,1-3H3,(H,13,15)/t9-,10?/m0/s1.
What are the key properties of N-methyl-2-[[(1S)-1-phenylethyl]amino]propanamide?
N-methyl-2-[[(1S)-1-phenylethyl]amino]propanamide has a molecular weight of 206.29 g/mol, XLogP of 1.47, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[[(1S)-1-phenylethyl]amino]propanamide is sourced from PubChem (CID 63866912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).