(3R)-3-amino-4-(2-fluorophenyl)butanamide

C10H13FN2O — CID 143290720

IUPAC(3R)-3-amino-4-(2-fluorophenyl)butanamide
SMILESNC(=O)C[C@H](N)Cc1ccccc1F
InChIInChI=1S/C10H13FN2O/c11-9-4-2-1-3-7(9)5-8(12)6-10(13)14/h1-4,8H,5-6,12H2,(H2,13,14)/t8-/m1/s1
InChIKeyITQRLRWENGEFHJ-MRVPVSSYSA-N
MW196.23 g/mol
LogP0.57
Rot. Bonds4

About (3R)-3-amino-4-(2-fluorophenyl)butanamide

(3R)-3-amino-4-(2-fluorophenyl)butanamide (PubChem CID 143290720) has the molecular formula C10H13FN2O and a molecular weight of 196.23 g/mol. Its IUPAC name is (3R)-3-amino-4-(2-fluorophenyl)butanamide.

Molecular Properties

Compound Name(3R)-3-amino-4-(2-fluorophenyl)butanamide
PubChem CID143290720
Molecular FormulaC10H13FN2O
Molecular Weight196.23 g/mol
Exact Mass196.10
IUPAC Name(3R)-3-amino-4-(2-fluorophenyl)butanamide
SMILESNC(=O)C[C@H](N)Cc1ccccc1F
InChIInChI=1S/C10H13FN2O/c11-9-4-2-1-3-7(9)5-8(12)6-10(13)14/h1-4,8H,5-6,12H2,(H2,13,14)/t8-/m1/s1
InChIKeyITQRLRWENGEFHJ-MRVPVSSYSA-N
XLogP0.57
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.23
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(4R)-4-amino-5-(2-fluorophenyl)pentan-2-one
CID 59650649
2-amino-3-(2-fluorophenyl)propan-1-ol;hydrochloride
CID 3048994
(2S)-2-amino-3-(2-fluorophenyl)propanoic acid
CID 716319
bis(2-amino-3-(2-fluorophenyl)propanoic acid);hydrate
CID 78291296
2-(2-fluorophenyl)acetamide;hydrochloride
CID 68904503
(3R)-3-amino-4-(2-fluorophenyl)-N-(2-pyridin-2-ylethyl)butanamide
CID 11543968
(3R)-3-amino-4-(2-fluorophenyl)-N-methyl-N-[(2-methylsulfanylphenyl)methyl]butanamide
CID 11695925
(3R)-3-amino-N-[1-(4-chlorophenyl)ethyl]-4-(2-fluorophenyl)butanamide
CID 11616967
2-amino-1-(2-fluorophenyl)pentan-3-one
CID 77428239
2-amino-3-(2-fluorophenyl)-N-methylpropanamide
CID 116850583
(3R)-3-amino-4-(2-fluorophenyl)-N-[(2R)-1-(methylamino)-1-oxo-3-phenylpropan-2-yl]butanamide
CID 11233630
(3R)-3-amino-4-(2-fluorophenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]butanamide
CID 11537671

Frequently Asked Questions

What is the IUPAC name of (3R)-3-amino-4-(2-fluorophenyl)butanamide?
The IUPAC name of (3R)-3-amino-4-(2-fluorophenyl)butanamide (CID 143290720) is (3R)-3-amino-4-(2-fluorophenyl)butanamide.
What is the SMILES notation for (3R)-3-amino-4-(2-fluorophenyl)butanamide?
The canonical SMILES for (3R)-3-amino-4-(2-fluorophenyl)butanamide is NC(=O)C[C@H](N)Cc1ccccc1F.
What is the InChIKey of (3R)-3-amino-4-(2-fluorophenyl)butanamide?
The InChIKey is ITQRLRWENGEFHJ-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H13FN2O/c11-9-4-2-1-3-7(9)5-8(12)6-10(13)14/h1-4,8H,5-6,12H2,(H2,13,14)/t8-/m1/s1.
What are the key properties of (3R)-3-amino-4-(2-fluorophenyl)butanamide?
(3R)-3-amino-4-(2-fluorophenyl)butanamide has a molecular weight of 196.23 g/mol, XLogP of 0.57, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-amino-4-(2-fluorophenyl)butanamide is sourced from PubChem (CID 143290720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).