N'-(cyclohexanecarbonyl)-2-propan-2-yloxybenzohydrazide

C17H24N2O3 — CID 17045681

IUPACN'-(cyclohexanecarbonyl)-2-propan-2-yloxybenzohydrazide
SMILESCC(C)Oc1ccccc1C(=O)NNC(=O)C1CCCCC1
InChIInChI=1S/C17H24N2O3/c1-12(2)22-15-11-7-6-10-14(15)17(21)19-18-16(20)13-8-4-3-5-9-13/h6-7,10-13H,3-5,8-9H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyKHHCHVYOHWROOU-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.82
Rot. Bonds4

About N'-(cyclohexanecarbonyl)-2-propan-2-yloxybenzohydrazide

N'-(cyclohexanecarbonyl)-2-propan-2-yloxybenzohydrazide (PubChem CID 17045681) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is N'-(cyclohexanecarbonyl)-2-propan-2-yloxybenzohydrazide.

Molecular Properties

Compound NameN'-(cyclohexanecarbonyl)-2-propan-2-yloxybenzohydrazide
PubChem CID17045681
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC NameN'-(cyclohexanecarbonyl)-2-propan-2-yloxybenzohydrazide
SMILESCC(C)Oc1ccccc1C(=O)NNC(=O)C1CCCCC1
InChIInChI=1S/C17H24N2O3/c1-12(2)22-15-11-7-6-10-14(15)17(21)19-18-16(20)13-8-4-3-5-9-13/h6-7,10-13H,3-5,8-9H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyKHHCHVYOHWROOU-UHFFFAOYSA-N
XLogP2.82
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N'-(cyclopentanecarbonyl)benzohydrazide
CID 101455065
N-[[(2-chlorobenzoyl)amino]carbamothioyl]-2-propan-2-yloxybenzamide
CID 17045953
N-[3-(cyclopropanecarbonylamino)-2-methylphenyl]-2-propan-2-yloxybenzamide
CID 46761350
N'-(2,2-diphenylacetyl)-2-propan-2-yloxybenzohydrazide
CID 17045646
2-propan-2-yloxy-N-[4-[(2-propan-2-yloxybenzoyl)amino]phenyl]benzamide
CID 17046033
N'-(2-propan-2-yloxybenzoyl)-2-prop-2-enoxybenzohydrazide
CID 17045713
N-[2-oxo-2-(2-propan-2-yloxyanilino)ethyl]cyclohexanecarboxamide
CID 112998973
N-propan-2-yl-2-[(2-propan-2-yloxybenzoyl)amino]benzamide
CID 17045597
N'-(cyclopropanecarbonyl)-2-prop-2-enoxybenzohydrazide
CID 4929134
N-[1-[(2-propan-2-yloxyphenyl)methyl]piperidin-4-yl]cyclohexanecarboxamide
CID 86860877
N'-(cyclopropanecarbonyl)-2-[2-[(2R)-2-methylpiperidin-1-yl]ethoxy]benzohydrazide
CID 95151097
N'-(cyclopropanecarbonyl)-2-methylsulfanylbenzohydrazide
CID 26798777

Frequently Asked Questions

What is the IUPAC name of N'-(cyclohexanecarbonyl)-2-propan-2-yloxybenzohydrazide?
The IUPAC name of N'-(cyclohexanecarbonyl)-2-propan-2-yloxybenzohydrazide (CID 17045681) is N'-(cyclohexanecarbonyl)-2-propan-2-yloxybenzohydrazide.
What is the SMILES notation for N'-(cyclohexanecarbonyl)-2-propan-2-yloxybenzohydrazide?
The canonical SMILES for N'-(cyclohexanecarbonyl)-2-propan-2-yloxybenzohydrazide is CC(C)Oc1ccccc1C(=O)NNC(=O)C1CCCCC1.
What is the InChIKey of N'-(cyclohexanecarbonyl)-2-propan-2-yloxybenzohydrazide?
The InChIKey is KHHCHVYOHWROOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-12(2)22-15-11-7-6-10-14(15)17(21)19-18-16(20)13-8-4-3-5-9-13/h6-7,10-13H,3-5,8-9H2,1-2H3,(H,18,20)(H,19,21).
What are the key properties of N'-(cyclohexanecarbonyl)-2-propan-2-yloxybenzohydrazide?
N'-(cyclohexanecarbonyl)-2-propan-2-yloxybenzohydrazide has a molecular weight of 304.39 g/mol, XLogP of 2.82, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(cyclohexanecarbonyl)-2-propan-2-yloxybenzohydrazide is sourced from PubChem (CID 17045681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).