(2R)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]propanamide

C13H20N2O — CID 9132466

IUPAC(2R)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]propanamide
SMILESCC(C)[C@@H](N[C@H](C)C(N)=O)c1ccccc1
InChIInChI=1S/C13H20N2O/c1-9(2)12(15-10(3)13(14)16)11-7-5-4-6-8-11/h4-10,12,15H,1-3H3,(H2,14,16)/t10-,12-/m1/s1
InChIKeyJOXXDQSETIXAMQ-ZYHUDNBSSA-N
MW220.32 g/mol
LogP1.85
Rot. Bonds5

About (2R)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]propanamide

(2R)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]propanamide (PubChem CID 9132466) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is (2R)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]propanamide.

Molecular Properties

Compound Name(2R)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]propanamide
PubChem CID9132466
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name(2R)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]propanamide
SMILESCC(C)[C@@H](N[C@H](C)C(N)=O)c1ccccc1
InChIInChI=1S/C13H20N2O/c1-9(2)12(15-10(3)13(14)16)11-7-5-4-6-8-11/h4-10,12,15H,1-3H3,(H2,14,16)/t10-,12-/m1/s1
InChIKeyJOXXDQSETIXAMQ-ZYHUDNBSSA-N
XLogP1.85
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-[[(1S)-2-methyl-1-phenylpropyl]amino]propanamide
CID 9132458
2-[(2-methyl-1-phenylpropyl)amino]-N-propan-2-ylpropanamide
CID 112683279
(2S)-2-[[(1S)-2-methyl-1-[4-(2-methylpropyl)phenyl]propyl]amino]propanamide
CID 8996099
(2R)-2-[[(1R)-2-methyl-1-[4-(2-methylpropyl)phenyl]propyl]amino]propanamide
CID 8996102
2-methyl-N-(2-methyl-1-phenylpropyl)-1-phenylpropan-1-amine
CID 3845327
N-tert-butyl-2-[(2-methyl-1-phenylpropyl)amino]propanamide
CID 115574031
methyl (2S)-3-methyl-2-[[(1S)-2-methyl-1-phenylpropyl]amino]butanoate
CID 93043992
N,N-diethyl-2-[(2-methyl-1-phenylpropyl)amino]propanamide
CID 43425569
2-(1-phenylbutylamino)propanamide
CID 43401102
2-[(2-methyl-1-phenylpropyl)amino]butanoic acid
CID 113292394
2-[1-(4-phenylphenyl)ethylamino]propanamide
CID 43398020
(2R)-N-(4-chlorophenyl)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]propanamide
CID 9132361

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]propanamide?
The IUPAC name of (2R)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]propanamide (CID 9132466) is (2R)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]propanamide.
What is the SMILES notation for (2R)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]propanamide?
The canonical SMILES for (2R)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]propanamide is CC(C)[C@@H](N[C@H](C)C(N)=O)c1ccccc1.
What is the InChIKey of (2R)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]propanamide?
The InChIKey is JOXXDQSETIXAMQ-ZYHUDNBSSA-N. The full InChI is InChI=1S/C13H20N2O/c1-9(2)12(15-10(3)13(14)16)11-7-5-4-6-8-11/h4-10,12,15H,1-3H3,(H2,14,16)/t10-,12-/m1/s1.
What are the key properties of (2R)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]propanamide?
(2R)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]propanamide has a molecular weight of 220.32 g/mol, XLogP of 1.85, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]propanamide is sourced from PubChem (CID 9132466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).