(2-ethyl-9H-fluoren-9-yl)methyl (1Z)-N-ethylethanehydrazonate

C20H24N2O — CID 91604509

IUPAC(2-ethyl-9H-fluoren-9-yl)methyl (1Z)-N-ethylethanehydrazonate
SMILESCCN/N=C(/C)OCC1c2ccccc2-c2ccc(CC)cc21
InChIInChI=1S/C20H24N2O/c1-4-15-10-11-18-16-8-6-7-9-17(16)20(19(18)12-15)13-23-14(3)22-21-5-2/h6-12,20-21H,4-5,13H2,1-3H3/b22-14-
InChIKeyYDVPWOJRFSBOSB-HMAPJEAMSA-N
MW308.43 g/mol
LogP4.32
Rot. Bonds5

About (2-ethyl-9H-fluoren-9-yl)methyl (1Z)-N-ethylethanehydrazonate

(2-ethyl-9H-fluoren-9-yl)methyl (1Z)-N-ethylethanehydrazonate (PubChem CID 91604509) has the molecular formula C20H24N2O and a molecular weight of 308.43 g/mol. Its IUPAC name is (2-ethyl-9H-fluoren-9-yl)methyl (1Z)-N-ethylethanehydrazonate.

Molecular Properties

Compound Name(2-ethyl-9H-fluoren-9-yl)methyl (1Z)-N-ethylethanehydrazonate
PubChem CID91604509
Molecular FormulaC20H24N2O
Molecular Weight308.43 g/mol
Exact Mass308.19
IUPAC Name(2-ethyl-9H-fluoren-9-yl)methyl (1Z)-N-ethylethanehydrazonate
SMILESCCN/N=C(/C)OCC1c2ccccc2-c2ccc(CC)cc21
InChIInChI=1S/C20H24N2O/c1-4-15-10-11-18-16-8-6-7-9-17(16)20(19(18)12-15)13-23-14(3)22-21-5-2/h6-12,20-21H,4-5,13H2,1-3H3/b22-14-
InChIKeyYDVPWOJRFSBOSB-HMAPJEAMSA-N
XLogP4.32
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(2,7-diethyl-9H-fluoren-9-yl)-4,6-bis(9H-fluoren-9-yl)-1,3,5-triazine
CID 147464174
9-(cyclopenta-1,3-dien-1-ylmethyl)-2-ethyl-9H-fluorene
CID 57060482
1,1-diphenylethylbenzene;1-ethyl-4-methoxybenzene;9H-fluoren-9-ylmethyl acetate
CID 91382042
[2-[[acetyl(methyl)amino]methyl]-9H-fluoren-9-yl]methyl N-(chloromethyl)-N-phenylcarbamate
CID 90221745
[2-[[acetyl(methyl)amino]methyl]-9H-fluoren-9-yl]methyl N-(iodomethyl)-N-phenylcarbamate
CID 90221747
9H-fluoren-9-ylmethyl N-[(Z)-heptan-3-ylideneamino]carbamate
CID 59032300
9H-fluoren-9-ylmethyl N-[4-(3-ethylphenyl)but-3-ynyl]carbamate
CID 170460285
methyl 9-(2-aminoethyl)-7-ethyl-9H-fluorene-2-carboxylate
CID 82579164
9H-fluoren-9-ylmethyl 4,4-dimethyl-3-oxopentanoate
CID 59055681
methyl 4-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]benzoate
CID 24720878
6-ethyl-3-[2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methoxy-3-oxopropyl]indole-1-carboxylic acid
CID 134210328
CID 58624123
CID 58624123

Frequently Asked Questions

What is the IUPAC name of (2-ethyl-9H-fluoren-9-yl)methyl (1Z)-N-ethylethanehydrazonate?
The IUPAC name of (2-ethyl-9H-fluoren-9-yl)methyl (1Z)-N-ethylethanehydrazonate (CID 91604509) is (2-ethyl-9H-fluoren-9-yl)methyl (1Z)-N-ethylethanehydrazonate.
What is the SMILES notation for (2-ethyl-9H-fluoren-9-yl)methyl (1Z)-N-ethylethanehydrazonate?
The canonical SMILES for (2-ethyl-9H-fluoren-9-yl)methyl (1Z)-N-ethylethanehydrazonate is CCN/N=C(/C)OCC1c2ccccc2-c2ccc(CC)cc21.
What is the InChIKey of (2-ethyl-9H-fluoren-9-yl)methyl (1Z)-N-ethylethanehydrazonate?
The InChIKey is YDVPWOJRFSBOSB-HMAPJEAMSA-N. The full InChI is InChI=1S/C20H24N2O/c1-4-15-10-11-18-16-8-6-7-9-17(16)20(19(18)12-15)13-23-14(3)22-21-5-2/h6-12,20-21H,4-5,13H2,1-3H3/b22-14-.
What are the key properties of (2-ethyl-9H-fluoren-9-yl)methyl (1Z)-N-ethylethanehydrazonate?
(2-ethyl-9H-fluoren-9-yl)methyl (1Z)-N-ethylethanehydrazonate has a molecular weight of 308.43 g/mol, XLogP of 4.32, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethyl-9H-fluoren-9-yl)methyl (1Z)-N-ethylethanehydrazonate is sourced from PubChem (CID 91604509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).