N-(3-amino-2-hydroxy-5-phenylpentanoyl)naphthalene-1-carbohydrazide

C22H23N3O3 — CID 85128191

IUPACN-(3-amino-2-hydroxy-5-phenylpentanoyl)naphthalene-1-carbohydrazide
SMILESNC(CCc1ccccc1)C(O)C(=O)N(N)C(=O)c1cccc2ccccc12
InChIInChI=1S/C22H23N3O3/c23-19(14-13-15-7-2-1-3-8-15)20(26)22(28)25(24)21(27)18-12-6-10-16-9-4-5-11-17(16)18/h1-12,19-20,26H,13-14,23-24H2
InChIKeyGGCZYTSWHZYSHV-UHFFFAOYSA-N
MW377.44 g/mol
LogP2.00
Rot. Bonds6

About N-(3-amino-2-hydroxy-5-phenylpentanoyl)naphthalene-1-carbohydrazide

N-(3-amino-2-hydroxy-5-phenylpentanoyl)naphthalene-1-carbohydrazide (PubChem CID 85128191) has the molecular formula C22H23N3O3 and a molecular weight of 377.44 g/mol. Its IUPAC name is N-(3-amino-2-hydroxy-5-phenylpentanoyl)naphthalene-1-carbohydrazide.

Molecular Properties

Compound NameN-(3-amino-2-hydroxy-5-phenylpentanoyl)naphthalene-1-carbohydrazide
PubChem CID85128191
Molecular FormulaC22H23N3O3
Molecular Weight377.44 g/mol
Exact Mass377.17
IUPAC NameN-(3-amino-2-hydroxy-5-phenylpentanoyl)naphthalene-1-carbohydrazide
SMILESNC(CCc1ccccc1)C(O)C(=O)N(N)C(=O)c1cccc2ccccc12
InChIInChI=1S/C22H23N3O3/c23-19(14-13-15-7-2-1-3-8-15)20(26)22(28)25(24)21(27)18-12-6-10-16-9-4-5-11-17(16)18/h1-12,19-20,26H,13-14,23-24H2
InChIKeyGGCZYTSWHZYSHV-UHFFFAOYSA-N
XLogP2.00
TPSA109.65 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 52.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-amino-2-hydroxy-5-phenylpentanoic acid
CID 22182665
N-(2-bromobenzoyl)naphthalene-1-carbohydrazide
CID 23622739
2-(2-phenylethyl)propanediamide
CID 66660020
1-naphthalen-1-yl-3-phenylpropan-1-one
CID 20764678
2-(2-phenylethyl)propanedioate
CID 21465102
N-fluoro-N-phenylnaphthalene-1-carboxamide
CID 90862687
(2R)-2-amino-3-naphthalen-1-yl-N-(2-phenylethyl)propanamide
CID 70832631
N-benzyl-N-tert-butylnaphthalene-1-carboxamide
CID 10914114
(2S)-2-amino-3-hydroxy-1-naphthalen-1-ylpropan-1-one
CID 173056322
2-amino-1,4-diphenylbutan-1-ol
CID 10847700
N-hydroxy-N-[4-[hydroxy(naphthalene-1-carbonyl)amino]phenyl]naphthalene-1-carboxamide
CID 56977411
(3R)-3-amino-2-hydroxy-5-methylsulfanyl-N-(2-phenylethyl)pentanamide;hydrochloride
CID 141016956

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-hydroxy-5-phenylpentanoyl)naphthalene-1-carbohydrazide?
The IUPAC name of N-(3-amino-2-hydroxy-5-phenylpentanoyl)naphthalene-1-carbohydrazide (CID 85128191) is N-(3-amino-2-hydroxy-5-phenylpentanoyl)naphthalene-1-carbohydrazide.
What is the SMILES notation for N-(3-amino-2-hydroxy-5-phenylpentanoyl)naphthalene-1-carbohydrazide?
The canonical SMILES for N-(3-amino-2-hydroxy-5-phenylpentanoyl)naphthalene-1-carbohydrazide is NC(CCc1ccccc1)C(O)C(=O)N(N)C(=O)c1cccc2ccccc12.
What is the InChIKey of N-(3-amino-2-hydroxy-5-phenylpentanoyl)naphthalene-1-carbohydrazide?
The InChIKey is GGCZYTSWHZYSHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O3/c23-19(14-13-15-7-2-1-3-8-15)20(26)22(28)25(24)21(27)18-12-6-10-16-9-4-5-11-17(16)18/h1-12,19-20,26H,13-14,23-24H2.
What are the key properties of N-(3-amino-2-hydroxy-5-phenylpentanoyl)naphthalene-1-carbohydrazide?
N-(3-amino-2-hydroxy-5-phenylpentanoyl)naphthalene-1-carbohydrazide has a molecular weight of 377.44 g/mol, XLogP of 2.00, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-hydroxy-5-phenylpentanoyl)naphthalene-1-carbohydrazide is sourced from PubChem (CID 85128191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).