N'-acetyl-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetohydrazide

C14H21N3O2 — CID 9132759

IUPACN'-acetyl-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetohydrazide
SMILESCC(=O)NNC(=O)CN[C@@H](c1ccccc1)C(C)C
InChIInChI=1S/C14H21N3O2/c1-10(2)14(12-7-5-4-6-8-12)15-9-13(19)17-16-11(3)18/h4-8,10,14-15H,9H2,1-3H3,(H,16,18)(H,17,19)/t14-/m1/s1
InChIKeyJGAQFGVLKYSQSZ-CQSZACIVSA-N
MW263.34 g/mol
LogP1.14
Rot. Bonds5

About N'-acetyl-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetohydrazide

N'-acetyl-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetohydrazide (PubChem CID 9132759) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N'-acetyl-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetohydrazide.

Molecular Properties

Compound NameN'-acetyl-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetohydrazide
PubChem CID9132759
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN'-acetyl-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetohydrazide
SMILESCC(=O)NNC(=O)CN[C@@H](c1ccccc1)C(C)C
InChIInChI=1S/C14H21N3O2/c1-10(2)14(12-7-5-4-6-8-12)15-9-13(19)17-16-11(3)18/h4-8,10,14-15H,9H2,1-3H3,(H,16,18)(H,17,19)/t14-/m1/s1
InChIKeyJGAQFGVLKYSQSZ-CQSZACIVSA-N
XLogP1.14
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(4-acetamidophenyl)-2-[[(1S)-2-methyl-1-phenylpropyl]amino]acetamide
CID 9131833
2-[[(1R)-2-methyl-1-phenylpropyl]amino]-N-[(1R)-1-phenylethyl]acetamide
CID 9131711
N-(3-acetamidophenyl)-2-[(2-methyl-1-phenylpropyl)amino]acetamide
CID 86909136
N-(ethylcarbamoyl)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetamide
CID 9132089
N-[(4-chlorophenyl)methyl]-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetamide
CID 9131540
N-(2,6-diethylphenyl)-2-[[(1S)-2-methyl-1-phenylpropyl]amino]acetamide
CID 9131674
2-[[(1S)-1-(4-fluorophenyl)-2-methylpropyl]amino]-N-[(1R)-1-phenylethyl]acetamide
CID 9133439
N-[2,6-di(propan-2-yl)phenyl]-2-[[(1S)-2-methyl-1-phenylpropyl]amino]acetamide
CID 9131955
2-[[(1S)-2-methyl-1-phenylpropyl]amino]-N-(2-methylpropylcarbamoyl)acetamide
CID 9132325
N-(2,3-dichlorophenyl)-2-[[(1S)-2-methyl-1-phenylpropyl]amino]acetamide
CID 9131743
2-[(2-methyl-1-phenylpropyl)amino]-N-(1-thiophen-2-ylethyl)acetamide
CID 86909139
2-[[(1S)-2-methyl-1-phenylpropyl]amino]-N-naphthalen-1-ylacetamide
CID 9131594

Frequently Asked Questions

What is the IUPAC name of N'-acetyl-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetohydrazide?
The IUPAC name of N'-acetyl-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetohydrazide (CID 9132759) is N'-acetyl-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetohydrazide.
What is the SMILES notation for N'-acetyl-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetohydrazide?
The canonical SMILES for N'-acetyl-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetohydrazide is CC(=O)NNC(=O)CN[C@@H](c1ccccc1)C(C)C.
What is the InChIKey of N'-acetyl-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetohydrazide?
The InChIKey is JGAQFGVLKYSQSZ-CQSZACIVSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-10(2)14(12-7-5-4-6-8-12)15-9-13(19)17-16-11(3)18/h4-8,10,14-15H,9H2,1-3H3,(H,16,18)(H,17,19)/t14-/m1/s1.
What are the key properties of N'-acetyl-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetohydrazide?
N'-acetyl-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetohydrazide has a molecular weight of 263.34 g/mol, XLogP of 1.14, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-acetyl-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetohydrazide is sourced from PubChem (CID 9132759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).