(1R,6R)-N'-[(1R)-2,2-diphenylcyclopropanecarbonyl]bicyclo[4.1.0]heptane-7-carbohydrazide

C24H26N2O2 — CID 99724415

IUPAC(1R,6R)-N'-[(1R)-2,2-diphenylcyclopropanecarbonyl]bicyclo[4.1.0]heptane-7-carbohydrazide
SMILESO=C(NNC(=O)[C@@H]1CC1(c1ccccc1)c1ccccc1)C1[C@@H]2CCCC[C@@H]12
InChIInChI=1S/C24H26N2O2/c27-22(25-26-23(28)21-18-13-7-8-14-19(18)21)20-15-24(20,16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-6,9-12,18-21H,7-8,13-15H2,(H,25,27)(H,26,28)/t18-,19-,20+/m1/s1
InChIKeyAZKGMFBPXAUNBU-AQNXPRMDSA-N
MW374.48 g/mol
LogP3.58
Rot. Bonds4

About (1R,6R)-N'-[(1R)-2,2-diphenylcyclopropanecarbonyl]bicyclo[4.1.0]heptane-7-carbohydrazide

(1R,6R)-N'-[(1R)-2,2-diphenylcyclopropanecarbonyl]bicyclo[4.1.0]heptane-7-carbohydrazide (PubChem CID 99724415) has the molecular formula C24H26N2O2 and a molecular weight of 374.48 g/mol. Its IUPAC name is (1R,6R)-N'-[(1R)-2,2-diphenylcyclopropanecarbonyl]bicyclo[4.1.0]heptane-7-carbohydrazide.

Molecular Properties

Compound Name(1R,6R)-N'-[(1R)-2,2-diphenylcyclopropanecarbonyl]bicyclo[4.1.0]heptane-7-carbohydrazide
PubChem CID99724415
Molecular FormulaC24H26N2O2
Molecular Weight374.48 g/mol
Exact Mass374.20
IUPAC Name(1R,6R)-N'-[(1R)-2,2-diphenylcyclopropanecarbonyl]bicyclo[4.1.0]heptane-7-carbohydrazide
SMILESO=C(NNC(=O)[C@@H]1CC1(c1ccccc1)c1ccccc1)C1[C@@H]2CCCC[C@@H]12
InChIInChI=1S/C24H26N2O2/c27-22(25-26-23(28)21-18-13-7-8-14-19(18)21)20-15-24(20,16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-6,9-12,18-21H,7-8,13-15H2,(H,25,27)(H,26,28)/t18-,19-,20+/m1/s1
InChIKeyAZKGMFBPXAUNBU-AQNXPRMDSA-N
XLogP3.58
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.48
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1R,6R)-N'-[(1R)-2,2-diphenylcyclopropanecarbonyl]bicyclo[4.1.0]heptane-7-carbohydrazide?
The IUPAC name of (1R,6R)-N'-[(1R)-2,2-diphenylcyclopropanecarbonyl]bicyclo[4.1.0]heptane-7-carbohydrazide (CID 99724415) is (1R,6R)-N'-[(1R)-2,2-diphenylcyclopropanecarbonyl]bicyclo[4.1.0]heptane-7-carbohydrazide.
What is the SMILES notation for (1R,6R)-N'-[(1R)-2,2-diphenylcyclopropanecarbonyl]bicyclo[4.1.0]heptane-7-carbohydrazide?
The canonical SMILES for (1R,6R)-N'-[(1R)-2,2-diphenylcyclopropanecarbonyl]bicyclo[4.1.0]heptane-7-carbohydrazide is O=C(NNC(=O)[C@@H]1CC1(c1ccccc1)c1ccccc1)C1[C@@H]2CCCC[C@@H]12.
What is the InChIKey of (1R,6R)-N'-[(1R)-2,2-diphenylcyclopropanecarbonyl]bicyclo[4.1.0]heptane-7-carbohydrazide?
The InChIKey is AZKGMFBPXAUNBU-AQNXPRMDSA-N. The full InChI is InChI=1S/C24H26N2O2/c27-22(25-26-23(28)21-18-13-7-8-14-19(18)21)20-15-24(20,16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-6,9-12,18-21H,7-8,13-15H2,(H,25,27)(H,26,28)/t18-,19-,20+/m1/s1.
What are the key properties of (1R,6R)-N'-[(1R)-2,2-diphenylcyclopropanecarbonyl]bicyclo[4.1.0]heptane-7-carbohydrazide?
(1R,6R)-N'-[(1R)-2,2-diphenylcyclopropanecarbonyl]bicyclo[4.1.0]heptane-7-carbohydrazide has a molecular weight of 374.48 g/mol, XLogP of 3.58, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,6R)-N'-[(1R)-2,2-diphenylcyclopropanecarbonyl]bicyclo[4.1.0]heptane-7-carbohydrazide is sourced from PubChem (CID 99724415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).