(4S)-4-amino-5-phenylpentanamide;hydrochloride

C11H17ClN2O — CID 137464473

IUPAC(4S)-4-amino-5-phenylpentanamide;hydrochloride
SMILESCl.NC(=O)CC[C@H](N)Cc1ccccc1
InChIInChI=1S/C11H16N2O.ClH/c12-10(6-7-11(13)14)8-9-4-2-1-3-5-9;/h1-5,10H,6-8,12H2,(H2,13,14);1H/t10-;/m0./s1
InChIKeyMXHQSORNKOUUSH-PPHPATTJSA-N
MW228.72 g/mol
LogP1.24
Rot. Bonds5

About (4S)-4-amino-5-phenylpentanamide;hydrochloride

(4S)-4-amino-5-phenylpentanamide;hydrochloride (PubChem CID 137464473) has the molecular formula C11H17ClN2O and a molecular weight of 228.72 g/mol. Its IUPAC name is (4S)-4-amino-5-phenylpentanamide;hydrochloride.

Molecular Properties

Compound Name(4S)-4-amino-5-phenylpentanamide;hydrochloride
PubChem CID137464473
Molecular FormulaC11H17ClN2O
Molecular Weight228.72 g/mol
Exact Mass228.10
IUPAC Name(4S)-4-amino-5-phenylpentanamide;hydrochloride
SMILESCl.NC(=O)CC[C@H](N)Cc1ccccc1
InChIInChI=1S/C11H16N2O.ClH/c12-10(6-7-11(13)14)8-9-4-2-1-3-5-9;/h1-5,10H,6-8,12H2,(H2,13,14);1H/t10-;/m0./s1
InChIKeyMXHQSORNKOUUSH-PPHPATTJSA-N
XLogP1.24
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.72
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-amino-6-phenylhexan-2-one
CID 90094782
(5S)-6-phenylhex-1-ene-2,5-diamine
CID 146226437
(2S)-2-amino-N-[(2R)-2-amino-3-phenylpropyl]pentanediamide
CID 44588252
(4S)-4-amino-5-phenylmethoxypentanamide
CID 90463454
ethyl (4S)-4-amino-5-phenylpentanoate
CID 46237823
(2R,5R)-1,6-diphenylhexane-2,5-diamine;methane
CID 160625551
(3-amino-4-phenylbutyl)carbamic acid
CID 68670324
S-[(2R)-2-amino-3-phenylpropyl] carbamothioate;hydrochloride
CID 137464272
methyl 10-amino-11-phenylundecanoate;hydrochloride
CID 141254127
1,4-diphenylbutan-2-amine
CID 60820174
acetic acid;[(2R)-2-amino-3-phenylpropyl] carbamate
CID 172866706
2-benzylheptanediamide
CID 154384370

Frequently Asked Questions

What is the IUPAC name of (4S)-4-amino-5-phenylpentanamide;hydrochloride?
The IUPAC name of (4S)-4-amino-5-phenylpentanamide;hydrochloride (CID 137464473) is (4S)-4-amino-5-phenylpentanamide;hydrochloride.
What is the SMILES notation for (4S)-4-amino-5-phenylpentanamide;hydrochloride?
The canonical SMILES for (4S)-4-amino-5-phenylpentanamide;hydrochloride is Cl.NC(=O)CC[C@H](N)Cc1ccccc1.
What is the InChIKey of (4S)-4-amino-5-phenylpentanamide;hydrochloride?
The InChIKey is MXHQSORNKOUUSH-PPHPATTJSA-N. The full InChI is InChI=1S/C11H16N2O.ClH/c12-10(6-7-11(13)14)8-9-4-2-1-3-5-9;/h1-5,10H,6-8,12H2,(H2,13,14);1H/t10-;/m0./s1.
What are the key properties of (4S)-4-amino-5-phenylpentanamide;hydrochloride?
(4S)-4-amino-5-phenylpentanamide;hydrochloride has a molecular weight of 228.72 g/mol, XLogP of 1.24, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-amino-5-phenylpentanamide;hydrochloride is sourced from PubChem (CID 137464473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).