9H-fluoren-9-ylmethyl N-(2,4,5-trimethylphenyl)carbamate

C24H23NO2 — CID 143777566

IUPAC9H-fluoren-9-ylmethyl N-(2,4,5-trimethylphenyl)carbamate
SMILESCc1cc(C)c(NC(=O)OCC2c3ccccc3-c3ccccc32)cc1C
InChIInChI=1S/C24H23NO2/c1-15-12-17(3)23(13-16(15)2)25-24(26)27-14-22-20-10-6-4-8-18(20)19-9-5-7-11-21(19)22/h4-13,22H,14H2,1-3H3,(H,25,26)
InChIKeyFZRGNYUUUZFWDU-UHFFFAOYSA-N
MW357.45 g/mol
LogP5.97
Rot. Bonds3

About 9H-fluoren-9-ylmethyl N-(2,4,5-trimethylphenyl)carbamate

9H-fluoren-9-ylmethyl N-(2,4,5-trimethylphenyl)carbamate (PubChem CID 143777566) has the molecular formula C24H23NO2 and a molecular weight of 357.45 g/mol. Its IUPAC name is 9H-fluoren-9-ylmethyl N-(2,4,5-trimethylphenyl)carbamate.

Molecular Properties

Compound Name9H-fluoren-9-ylmethyl N-(2,4,5-trimethylphenyl)carbamate
PubChem CID143777566
Molecular FormulaC24H23NO2
Molecular Weight357.45 g/mol
Exact Mass357.17
IUPAC Name9H-fluoren-9-ylmethyl N-(2,4,5-trimethylphenyl)carbamate
SMILESCc1cc(C)c(NC(=O)OCC2c3ccccc3-c3ccccc32)cc1C
InChIInChI=1S/C24H23NO2/c1-15-12-17(3)23(13-16(15)2)25-24(26)27-14-22-20-10-6-4-8-18(20)19-9-5-7-11-21(19)22/h4-13,22H,14H2,1-3H3,(H,25,26)
InChIKeyFZRGNYUUUZFWDU-UHFFFAOYSA-N
XLogP5.97
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.45
LogP ≤ 55.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

acetic acid;9H-fluoren-9-ylmethyl N-(2-phenylphenyl)carbamate
CID 66925363
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CID 22569039
9H-fluoren-9-ylmethyl N-(5-amino-2-hydroxyphenyl)carbamate
CID 130987687
2-(9H-fluoren-9-ylmethoxycarbonylamino)benzoate
CID 6958000
3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-hydroxybenzoic acid
CID 22569049
9H-fluoren-9-ylmethyl N-[3-(2,4,5-trimethylphenyl)prop-2-enyl]carbamate
CID 169469367
9H-fluoren-9-ylmethyl N-(methylamino)carbamate
CID 10516035
5-bromo-2-(9H-fluoren-9-ylmethoxycarbonylamino)benzoic acid
CID 10873832
4-amino-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-(methylamino)benzoic acid
CID 142685185
9H-fluoren-9-ylmethyl N-(4-aminophenyl)carbamate
CID 11450338
9H-fluoren-9-ylmethyl N-iodocarbamate
CID 118176347
9H-fluoren-9-ylmethyl N-aminocarbamate;hydrochloride
CID 23080809

Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-9-ylmethyl N-(2,4,5-trimethylphenyl)carbamate?
The IUPAC name of 9H-fluoren-9-ylmethyl N-(2,4,5-trimethylphenyl)carbamate (CID 143777566) is 9H-fluoren-9-ylmethyl N-(2,4,5-trimethylphenyl)carbamate.
What is the SMILES notation for 9H-fluoren-9-ylmethyl N-(2,4,5-trimethylphenyl)carbamate?
The canonical SMILES for 9H-fluoren-9-ylmethyl N-(2,4,5-trimethylphenyl)carbamate is Cc1cc(C)c(NC(=O)OCC2c3ccccc3-c3ccccc32)cc1C.
What is the InChIKey of 9H-fluoren-9-ylmethyl N-(2,4,5-trimethylphenyl)carbamate?
The InChIKey is FZRGNYUUUZFWDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23NO2/c1-15-12-17(3)23(13-16(15)2)25-24(26)27-14-22-20-10-6-4-8-18(20)19-9-5-7-11-21(19)22/h4-13,22H,14H2,1-3H3,(H,25,26).
What are the key properties of 9H-fluoren-9-ylmethyl N-(2,4,5-trimethylphenyl)carbamate?
9H-fluoren-9-ylmethyl N-(2,4,5-trimethylphenyl)carbamate has a molecular weight of 357.45 g/mol, XLogP of 5.97, 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-(2,4,5-trimethylphenyl)carbamate is sourced from PubChem (CID 143777566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).