2-cyclopentyl-N'-[2-(4-methylanilino)acetyl]acetohydrazide

C16H23N3O2 — CID 18140158

IUPAC2-cyclopentyl-N'-[2-(4-methylanilino)acetyl]acetohydrazide
SMILESCc1ccc(NCC(=O)NNC(=O)CC2CCCC2)cc1
InChIInChI=1S/C16H23N3O2/c1-12-6-8-14(9-7-12)17-11-16(21)19-18-15(20)10-13-4-2-3-5-13/h6-9,13,17H,2-5,10-11H2,1H3,(H,18,20)(H,19,21)
InChIKeyYDAFZXWABXIJSD-UHFFFAOYSA-N
MW289.38 g/mol
LogP2.13
Rot. Bonds5

About 2-cyclopentyl-N'-[2-(4-methylanilino)acetyl]acetohydrazide

2-cyclopentyl-N'-[2-(4-methylanilino)acetyl]acetohydrazide (PubChem CID 18140158) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 2-cyclopentyl-N'-[2-(4-methylanilino)acetyl]acetohydrazide.

Molecular Properties

Compound Name2-cyclopentyl-N'-[2-(4-methylanilino)acetyl]acetohydrazide
PubChem CID18140158
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name2-cyclopentyl-N'-[2-(4-methylanilino)acetyl]acetohydrazide
SMILESCc1ccc(NCC(=O)NNC(=O)CC2CCCC2)cc1
InChIInChI=1S/C16H23N3O2/c1-12-6-8-14(9-7-12)17-11-16(21)19-18-15(20)10-13-4-2-3-5-13/h6-9,13,17H,2-5,10-11H2,1H3,(H,18,20)(H,19,21)
InChIKeyYDAFZXWABXIJSD-UHFFFAOYSA-N
XLogP2.13
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 52.13
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

1-[[2-(4-methylanilino)acetyl]amino]-3-[[(2S)-oxolan-2-yl]methyl]thiourea
CID 8617768
1-cyclohexyl-3-[4-[2-[2-(4-methylanilino)acetyl]hydrazinyl]-4-oxobutyl]urea
CID 55513953
2-[3-[2-(4-methylanilino)-2-oxoethyl]cyclohexyl]-N-(4-methylphenyl)acetamide
CID 58862999
1-(2,2-dimethylpropanoyl)-N'-[2-(4-methylanilino)acetyl]piperidine-4-carbohydrazide
CID 18140177
N-[4-[[(2-cyclopentylacetyl)amino]carbamoyl]phenyl]acetamide
CID 54786522
N-(3-amino-4-methylphenyl)-2-cyclohexylacetamide
CID 43209699
N'-(cyclohexen-1-yl)-2-(4-methylanilino)acetohydrazide
CID 5077247
2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide
CID 28566911
cyclobutyl 2-(4-methylanilino)acetate
CID 62217583
N-(4-bromo-3-methylphenyl)-2-cyclopentylacetamide
CID 2679466
N-cyclopropyl-4-[3-[2-[2-(4-methylanilino)acetyl]hydrazinyl]-3-oxopropyl]benzenesulfonamide
CID 56504390
N'-[2-(4-methylanilino)acetyl]-2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]acetohydrazide
CID 78823652

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N'-[2-(4-methylanilino)acetyl]acetohydrazide?
The IUPAC name of 2-cyclopentyl-N'-[2-(4-methylanilino)acetyl]acetohydrazide (CID 18140158) is 2-cyclopentyl-N'-[2-(4-methylanilino)acetyl]acetohydrazide.
What is the SMILES notation for 2-cyclopentyl-N'-[2-(4-methylanilino)acetyl]acetohydrazide?
The canonical SMILES for 2-cyclopentyl-N'-[2-(4-methylanilino)acetyl]acetohydrazide is Cc1ccc(NCC(=O)NNC(=O)CC2CCCC2)cc1.
What is the InChIKey of 2-cyclopentyl-N'-[2-(4-methylanilino)acetyl]acetohydrazide?
The InChIKey is YDAFZXWABXIJSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-12-6-8-14(9-7-12)17-11-16(21)19-18-15(20)10-13-4-2-3-5-13/h6-9,13,17H,2-5,10-11H2,1H3,(H,18,20)(H,19,21).
What are the key properties of 2-cyclopentyl-N'-[2-(4-methylanilino)acetyl]acetohydrazide?
2-cyclopentyl-N'-[2-(4-methylanilino)acetyl]acetohydrazide has a molecular weight of 289.38 g/mol, XLogP of 2.13, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N'-[2-(4-methylanilino)acetyl]acetohydrazide is sourced from PubChem (CID 18140158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).