9H-fluoren-9-ylmethyl N-(2-methylcyclohexyl)carbamate

C22H25NO2 — CID 70659072

IUPAC9H-fluoren-9-ylmethyl N-(2-methylcyclohexyl)carbamate
SMILESCC1CCCCC1NC(=O)OCC1c2ccccc2-c2ccccc21
InChIInChI=1S/C22H25NO2/c1-15-8-2-7-13-21(15)23-22(24)25-14-20-18-11-5-3-9-16(18)17-10-4-6-12-19(17)20/h3-6,9-12,15,20-21H,2,7-8,13-14H2,1H3,(H,23,24)
InChIKeyNOWYBTGGVLZMPV-UHFFFAOYSA-N
MW335.45 g/mol
LogP5.10
Rot. Bonds3

About 9H-fluoren-9-ylmethyl N-(2-methylcyclohexyl)carbamate

9H-fluoren-9-ylmethyl N-(2-methylcyclohexyl)carbamate (PubChem CID 70659072) has the molecular formula C22H25NO2 and a molecular weight of 335.45 g/mol. Its IUPAC name is 9H-fluoren-9-ylmethyl N-(2-methylcyclohexyl)carbamate.

Molecular Properties

Compound Name9H-fluoren-9-ylmethyl N-(2-methylcyclohexyl)carbamate
PubChem CID70659072
Molecular FormulaC22H25NO2
Molecular Weight335.45 g/mol
Exact Mass335.19
IUPAC Name9H-fluoren-9-ylmethyl N-(2-methylcyclohexyl)carbamate
SMILESCC1CCCCC1NC(=O)OCC1c2ccccc2-c2ccccc21
InChIInChI=1S/C22H25NO2/c1-15-8-2-7-13-21(15)23-22(24)25-14-20-18-11-5-3-9-16(18)17-10-4-6-12-19(17)20/h3-6,9-12,15,20-21H,2,7-8,13-14H2,1H3,(H,23,24)
InChIKeyNOWYBTGGVLZMPV-UHFFFAOYSA-N
XLogP5.10
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.45
LogP ≤ 55.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 9H-fluoren-9-ylmethyl N-(2-methylcyclohexyl)carbamate 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

cis-(1R,2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)cycloheptane-1-carboxylic acid;cis-(1S,2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)cycloheptane-1-carboxylic acid
CID 127239806
cis-(1S,2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)cycloheptane-1-carboxylic acid
CID 91758019
2-(9H-fluoren-9-ylmethoxycarbonylamino)cyclopentane-1-carboxylic acid
CID 4712584
cis-(1S,2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)cyclohexane-1-carboxylate
CID 86295180
2-[(1R,2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)cyclohexyl]acetic acid
CID 170899998
9H-fluoren-9-ylmethyl N-[(3R,4S)-4-hydroxyoxolan-3-yl]carbamate
CID 130689635
cis-(1S,2R)-2-[[3-(9H-fluoren-9-ylmethoxycarbonylamino)oxolane-2-carbonyl]amino]cyclohexane-1-carboxylic acid
CID 178193574
1-[[(1S,2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)cycloheptanecarbonyl]amino]cyclopropane-1-carboxylic acid
CID 178191458
cis-(1R,2S)-2-[[3-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methylpropanoyl]amino]cyclohexane-1-carboxylic acid
CID 178191918
(2S)-2-[[2-[(1R,2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)cyclohexyl]acetyl]amino]propanoic acid
CID 178199342
(2S)-2-[[(1S,2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)cyclohexanecarbonyl]amino]-3-methylbutanoic acid
CID 178190822
(2R)-2-[[(1S,2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)cycloheptanecarbonyl]amino]butanoic acid
CID 178195867

Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-9-ylmethyl N-(2-methylcyclohexyl)carbamate?
The IUPAC name of 9H-fluoren-9-ylmethyl N-(2-methylcyclohexyl)carbamate (CID 70659072) is 9H-fluoren-9-ylmethyl N-(2-methylcyclohexyl)carbamate.
What is the SMILES notation for 9H-fluoren-9-ylmethyl N-(2-methylcyclohexyl)carbamate?
The canonical SMILES for 9H-fluoren-9-ylmethyl N-(2-methylcyclohexyl)carbamate is CC1CCCCC1NC(=O)OCC1c2ccccc2-c2ccccc21.
What is the InChIKey of 9H-fluoren-9-ylmethyl N-(2-methylcyclohexyl)carbamate?
The InChIKey is NOWYBTGGVLZMPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25NO2/c1-15-8-2-7-13-21(15)23-22(24)25-14-20-18-11-5-3-9-16(18)17-10-4-6-12-19(17)20/h3-6,9-12,15,20-21H,2,7-8,13-14H2,1H3,(H,23,24).
What are the key properties of 9H-fluoren-9-ylmethyl N-(2-methylcyclohexyl)carbamate?
9H-fluoren-9-ylmethyl N-(2-methylcyclohexyl)carbamate has a molecular weight of 335.45 g/mol, XLogP of 5.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-fluoren-9-ylmethyl N-(2-methylcyclohexyl)carbamate is sourced from PubChem (CID 70659072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).