(2R)-N-methyl-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-phenylpropanamide

C16H25N3O2 — CID 9049639

IUPAC(2R)-N-methyl-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-phenylpropanamide
SMILESCC(C)NC(=O)CN(C)[C@H](C)C(=O)N(C)c1ccccc1
InChIInChI=1S/C16H25N3O2/c1-12(2)17-15(20)11-18(4)13(3)16(21)19(5)14-9-7-6-8-10-14/h6-10,12-13H,11H2,1-5H3,(H,17,20)/t13-/m1/s1
InChIKeyOBRXDLWVYFOKMZ-CYBMUJFWSA-N
MW291.39 g/mol
LogP1.49
Rot. Bonds6

About (2R)-N-methyl-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-phenylpropanamide

(2R)-N-methyl-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-phenylpropanamide (PubChem CID 9049639) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is (2R)-N-methyl-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-phenylpropanamide.

Molecular Properties

Compound Name(2R)-N-methyl-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-phenylpropanamide
PubChem CID9049639
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC Name(2R)-N-methyl-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-phenylpropanamide
SMILESCC(C)NC(=O)CN(C)[C@H](C)C(=O)N(C)c1ccccc1
InChIInChI=1S/C16H25N3O2/c1-12(2)17-15(20)11-18(4)13(3)16(21)19(5)14-9-7-6-8-10-14/h6-10,12-13H,11H2,1-5H3,(H,17,20)/t13-/m1/s1
InChIKeyOBRXDLWVYFOKMZ-CYBMUJFWSA-N
XLogP1.49
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2R)-N-methyl-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-phenylpropanamide 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

(2S)-N-methyl-2-[methyl-[2-[(6-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]-N-phenylpropanamide
CID 95186985
N-methyl-2-[methyl-[2-[(6-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]-N-phenylpropanamide
CID 56803962
(2S)-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-phenylphenyl)propanamide
CID 9049661
(2R)-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-[(1S)-1-phenylbutyl]propanamide
CID 8914313
2-[benzyl(methyl)amino]-N-propan-2-ylacetamide
CID 54808895
(2S)-N-(methylcarbamoyl)-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-2-phenylacetamide
CID 8912953
2-[[1-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-N-propan-2-ylacetamide
CID 60681805
2-[methyl-[2-[[(1S)-3-methyl-1-phenylbutyl]amino]-2-oxoethyl]amino]-N-propan-2-ylacetamide
CID 8913845
2-[[(2S)-1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]-methylamino]-N-propan-2-ylacetamide
CID 9049766
2-[methyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-N-propan-2-ylacetamide
CID 8913700
N'-phenyl-N,N'-di(propan-2-yl)propanediamide
CID 71028151
2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]benzoic acid
CID 55037894

Frequently Asked Questions

What is the IUPAC name of (2R)-N-methyl-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-phenylpropanamide?
The IUPAC name of (2R)-N-methyl-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-phenylpropanamide (CID 9049639) is (2R)-N-methyl-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-phenylpropanamide.
What is the SMILES notation for (2R)-N-methyl-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-phenylpropanamide?
The canonical SMILES for (2R)-N-methyl-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-phenylpropanamide is CC(C)NC(=O)CN(C)[C@H](C)C(=O)N(C)c1ccccc1.
What is the InChIKey of (2R)-N-methyl-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-phenylpropanamide?
The InChIKey is OBRXDLWVYFOKMZ-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-12(2)17-15(20)11-18(4)13(3)16(21)19(5)14-9-7-6-8-10-14/h6-10,12-13H,11H2,1-5H3,(H,17,20)/t13-/m1/s1.
What are the key properties of (2R)-N-methyl-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-phenylpropanamide?
(2R)-N-methyl-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-phenylpropanamide has a molecular weight of 291.39 g/mol, XLogP of 1.49, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-methyl-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-phenylpropanamide is sourced from PubChem (CID 9049639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).