(2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide

C13H20N2O — CID 14620809

IUPAC(2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide
SMILESCC(CCc1ccccc1)NC(=O)[C@@H](C)N
InChIInChI=1S/C13H20N2O/c1-10(15-13(16)11(2)14)8-9-12-6-4-3-5-7-12/h3-7,10-11H,8-9,14H2,1-2H3,(H,15,16)/t10?,11-/m1/s1
InChIKeyKSZZKWUYZAQCDG-RRKGBCIJSA-N
MW220.32 g/mol
LogP1.47
Rot. Bonds5

About (2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide

(2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide (PubChem CID 14620809) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is (2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide
PubChem CID14620809
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name(2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide
SMILESCC(CCc1ccccc1)NC(=O)[C@@H](C)N
InChIInChI=1S/C13H20N2O/c1-10(15-13(16)11(2)14)8-9-12-6-4-3-5-7-12/h3-7,10-11H,8-9,14H2,1-2H3,(H,15,16)/t10?,11-/m1/s1
InChIKeyKSZZKWUYZAQCDG-RRKGBCIJSA-N
XLogP1.47
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 ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-amino-N-(1-phenylpropan-2-yl)propanamide
CID 78923419
2-amino-2-phenyl-N-(4-phenylbutan-2-yl)acetamide
CID 61254237
N-[(2S)-4-phenylbutan-2-yl]acetamide
CID 6933208
4-amino-2-methyl-N-(4-phenylbutan-2-yl)butanamide
CID 80543602
(2S)-2-(methylamino)-N-[(2R)-4-phenylbutan-2-yl]propanamide
CID 143330073
3-[[(2S)-2-amino-4-phenylbutanoyl]amino]butanoic acid
CID 104984129
(2S)-2-amino-N-(4-hydroxybutan-2-yl)-4-phenylbutanamide
CID 104984748
N,N'-bis[(2S)-4-phenylbutan-2-yl]butanediamide
CID 7409928
3-oxo-3-(4-phenylbutan-2-ylamino)propanoic acid
CID 55049062
methyl N-[(2S)-4-phenylbutan-2-yl]carbamate
CID 888027
(2R)-2-bromo-N-[(2R)-4-phenylbutan-2-yl]butanamide
CID 51660002
(2S)-2-amino-N-(1-phenylmethoxypropan-2-yl)propanamide;hydrochloride
CID 119335271

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide?
The IUPAC name of (2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide (CID 14620809) is (2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide.
What is the SMILES notation for (2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide?
The canonical SMILES for (2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide is CC(CCc1ccccc1)NC(=O)[C@@H](C)N.
What is the InChIKey of (2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide?
The InChIKey is KSZZKWUYZAQCDG-RRKGBCIJSA-N. The full InChI is InChI=1S/C13H20N2O/c1-10(15-13(16)11(2)14)8-9-12-6-4-3-5-7-12/h3-7,10-11H,8-9,14H2,1-2H3,(H,15,16)/t10?,11-/m1/s1.
What are the key properties of (2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide?
(2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide has a molecular weight of 220.32 g/mol, XLogP of 1.47, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide is sourced from PubChem (CID 14620809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).