4-cyclohexyl-N-[(2R)-1-hydrazinyl-1,4-dioxopentan-2-yl]butanamide

C15H27N3O3 — CID 162387943

IUPAC4-cyclohexyl-N-[(2R)-1-hydrazinyl-1,4-dioxopentan-2-yl]butanamide
SMILESCC(=O)C[C@@H](NC(=O)CCCC1CCCCC1)C(=O)NN
InChIInChI=1S/C15H27N3O3/c1-11(19)10-13(15(21)18-16)17-14(20)9-5-8-12-6-3-2-4-7-12/h12-13H,2-10,16H2,1H3,(H,17,20)(H,18,21)/t13-/m1/s1
InChIKeyIDEMZQWCNUMBPS-CYBMUJFWSA-N
MW297.40 g/mol
LogP1.19
Rot. Bonds8

About 4-cyclohexyl-N-[(2R)-1-hydrazinyl-1,4-dioxopentan-2-yl]butanamide

4-cyclohexyl-N-[(2R)-1-hydrazinyl-1,4-dioxopentan-2-yl]butanamide (PubChem CID 162387943) has the molecular formula C15H27N3O3 and a molecular weight of 297.40 g/mol. Its IUPAC name is 4-cyclohexyl-N-[(2R)-1-hydrazinyl-1,4-dioxopentan-2-yl]butanamide.

Molecular Properties

Compound Name4-cyclohexyl-N-[(2R)-1-hydrazinyl-1,4-dioxopentan-2-yl]butanamide
PubChem CID162387943
Molecular FormulaC15H27N3O3
Molecular Weight297.40 g/mol
Exact Mass297.21
IUPAC Name4-cyclohexyl-N-[(2R)-1-hydrazinyl-1,4-dioxopentan-2-yl]butanamide
SMILESCC(=O)C[C@@H](NC(=O)CCCC1CCCCC1)C(=O)NN
InChIInChI=1S/C15H27N3O3/c1-11(19)10-13(15(21)18-16)17-14(20)9-5-8-12-6-3-2-4-7-12/h12-13H,2-10,16H2,1H3,(H,17,20)(H,18,21)/t13-/m1/s1
InChIKeyIDEMZQWCNUMBPS-CYBMUJFWSA-N
XLogP1.19
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 51.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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'}

Analyze 4-cyclohexyl-N-[(2R)-1-hydrazinyl-1,4-dioxopentan-2-yl]butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-cyclohexylbutanoylamino)hexanoic acid
CID 43387726
(2R)-2-(4-cycloheptylbutanoylamino)-N-(2-phenylethyl)butanediamide
CID 162387399
(2R)-2-(4-cyclohexylbutanoylamino)-N-[2-(4-hydroxyphenyl)ethyl]butanediamide
CID 162387199
5-cyclopentylpentan-2-one
CID 18433881
4-cyclohexyl-N-(1-methoxypropan-2-yl)butanamide
CID 78785346
N-(1-amino-4-methylpentan-2-yl)-4-cyclopentylbutanamide;hydrochloride
CID 119588873
(2R)-2-(3-cyclohexylpropanoylamino)hexanedioic acid
CID 107831353
3-(4-cyclohexylbutanoylamino)propanoic acid
CID 43241269
2-(3-cyclohexylpropanoylamino)pentanedioic acid
CID 60708364
N-(1-amino-2-methylpropan-2-yl)-4-cyclohexylbutanamide;hydrochloride
CID 119523315
methyl 3-(4-cyclohexylbutanoylamino)-2-hydroxypropanoate
CID 103879246
4-cyclohexylbutanoic acid;λ2-plumbane
CID 173062750

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-N-[(2R)-1-hydrazinyl-1,4-dioxopentan-2-yl]butanamide?
The IUPAC name of 4-cyclohexyl-N-[(2R)-1-hydrazinyl-1,4-dioxopentan-2-yl]butanamide (CID 162387943) is 4-cyclohexyl-N-[(2R)-1-hydrazinyl-1,4-dioxopentan-2-yl]butanamide.
What is the SMILES notation for 4-cyclohexyl-N-[(2R)-1-hydrazinyl-1,4-dioxopentan-2-yl]butanamide?
The canonical SMILES for 4-cyclohexyl-N-[(2R)-1-hydrazinyl-1,4-dioxopentan-2-yl]butanamide is CC(=O)C[C@@H](NC(=O)CCCC1CCCCC1)C(=O)NN.
What is the InChIKey of 4-cyclohexyl-N-[(2R)-1-hydrazinyl-1,4-dioxopentan-2-yl]butanamide?
The InChIKey is IDEMZQWCNUMBPS-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H27N3O3/c1-11(19)10-13(15(21)18-16)17-14(20)9-5-8-12-6-3-2-4-7-12/h12-13H,2-10,16H2,1H3,(H,17,20)(H,18,21)/t13-/m1/s1.
What are the key properties of 4-cyclohexyl-N-[(2R)-1-hydrazinyl-1,4-dioxopentan-2-yl]butanamide?
4-cyclohexyl-N-[(2R)-1-hydrazinyl-1,4-dioxopentan-2-yl]butanamide has a molecular weight of 297.40 g/mol, XLogP of 1.19, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-N-[(2R)-1-hydrazinyl-1,4-dioxopentan-2-yl]butanamide is sourced from PubChem (CID 162387943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).