2-methyl-N'-[(4R)-4-phenylcyclohexen-1-yl]furan-3-carbohydrazide

C18H20N2O2 — CID 2386188

IUPAC2-methyl-N'-[(4R)-4-phenylcyclohexen-1-yl]furan-3-carbohydrazide
SMILESCc1occc1C(=O)NNC1=CC[C@H](c2ccccc2)CC1
InChIInChI=1S/C18H20N2O2/c1-13-17(11-12-22-13)18(21)20-19-16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-6,9,11-12,15,19H,7-8,10H2,1H3,(H,20,21)/t15-/m0/s1
InChIKeyUKMDBVFUTBLYKK-HNNXBMFYSA-N
MW296.37 g/mol
LogP3.67
Rot. Bonds4

About 2-methyl-N'-[(4R)-4-phenylcyclohexen-1-yl]furan-3-carbohydrazide

2-methyl-N'-[(4R)-4-phenylcyclohexen-1-yl]furan-3-carbohydrazide (PubChem CID 2386188) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-methyl-N'-[(4R)-4-phenylcyclohexen-1-yl]furan-3-carbohydrazide.

Molecular Properties

Compound Name2-methyl-N'-[(4R)-4-phenylcyclohexen-1-yl]furan-3-carbohydrazide
PubChem CID2386188
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC Name2-methyl-N'-[(4R)-4-phenylcyclohexen-1-yl]furan-3-carbohydrazide
SMILESCc1occc1C(=O)NNC1=CC[C@H](c2ccccc2)CC1
InChIInChI=1S/C18H20N2O2/c1-13-17(11-12-22-13)18(21)20-19-16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-6,9,11-12,15,19H,7-8,10H2,1H3,(H,20,21)/t15-/m0/s1
InChIKeyUKMDBVFUTBLYKK-HNNXBMFYSA-N
XLogP3.67
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.67
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

N'-[(4R)-4-phenylcyclohexen-1-yl]acetohydrazide
CID 2163318
N'-(4-phenylcyclohexen-1-yl)pyridine-3-carbohydrazide
CID 3462848
1-(2-methoxyethyl)-3-[[(4R)-4-phenylcyclohexen-1-yl]amino]thiourea
CID 2424796
N-[(4S)-4-phenylcyclohexen-1-yl]formamide
CID 86313094
2-(4-methyl-2-propan-2-ylphenoxy)-N'-[(4S)-4-phenylcyclohexen-1-yl]acetohydrazide
CID 2391704
N-(2,3-dihydro-1H-inden-1-yl)-2-methylfuran-3-carboxamide
CID 47015555
N'-(2-methylfuran-3-carbonyl)-5-phenylpyrazolidine-3-carbohydrazide
CID 84865540
N'-[(4S)-4-tert-butylcyclohexen-1-yl]-2-pyrrol-1-ylbenzohydrazide
CID 2368192
1-N',4-N'-bis(2-methylfuran-3-carbonyl)benzene-1,4-dicarbohydrazide
CID 1011836
2,4-dimethyl-N'-[(4R)-4-methylcyclohexen-1-yl]benzohydrazide
CID 2350058
N-[(2-ethylcyclopentylidene)amino]-2-methylfuran-3-carboxamide
CID 3716947
N-(benzenesulfonyl)-2-methylfuran-3-carboxamide
CID 47231856

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N'-[(4R)-4-phenylcyclohexen-1-yl]furan-3-carbohydrazide?
The IUPAC name of 2-methyl-N'-[(4R)-4-phenylcyclohexen-1-yl]furan-3-carbohydrazide (CID 2386188) is 2-methyl-N'-[(4R)-4-phenylcyclohexen-1-yl]furan-3-carbohydrazide.
What is the SMILES notation for 2-methyl-N'-[(4R)-4-phenylcyclohexen-1-yl]furan-3-carbohydrazide?
The canonical SMILES for 2-methyl-N'-[(4R)-4-phenylcyclohexen-1-yl]furan-3-carbohydrazide is Cc1occc1C(=O)NNC1=CC[C@H](c2ccccc2)CC1.
What is the InChIKey of 2-methyl-N'-[(4R)-4-phenylcyclohexen-1-yl]furan-3-carbohydrazide?
The InChIKey is UKMDBVFUTBLYKK-HNNXBMFYSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-13-17(11-12-22-13)18(21)20-19-16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-6,9,11-12,15,19H,7-8,10H2,1H3,(H,20,21)/t15-/m0/s1.
What are the key properties of 2-methyl-N'-[(4R)-4-phenylcyclohexen-1-yl]furan-3-carbohydrazide?
2-methyl-N'-[(4R)-4-phenylcyclohexen-1-yl]furan-3-carbohydrazide has a molecular weight of 296.37 g/mol, XLogP of 3.67, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N'-[(4R)-4-phenylcyclohexen-1-yl]furan-3-carbohydrazide is sourced from PubChem (CID 2386188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).