9H-fluoren-9-ylmethyl N-[2-(hydroxymethyl)phenyl]carbamate

C22H19NO3 — CID 63310501

IUPAC9H-fluoren-9-ylmethyl N-[2-(hydroxymethyl)phenyl]carbamate
SMILESO=C(Nc1ccccc1CO)OCC1c2ccccc2-c2ccccc21
InChIInChI=1S/C22H19NO3/c24-13-15-7-1-6-12-21(15)23-22(25)26-14-20-18-10-4-2-8-16(18)17-9-3-5-11-19(17)20/h1-12,20,24H,13-14H2,(H,23,25)
InChIKeyHTYQZDJJJCVONI-UHFFFAOYSA-N
MW345.40 g/mol
LogP4.54
Rot. Bonds4

About 9H-fluoren-9-ylmethyl N-[2-(hydroxymethyl)phenyl]carbamate

9H-fluoren-9-ylmethyl N-[2-(hydroxymethyl)phenyl]carbamate (PubChem CID 63310501) has the molecular formula C22H19NO3 and a molecular weight of 345.40 g/mol. Its IUPAC name is 9H-fluoren-9-ylmethyl N-[2-(hydroxymethyl)phenyl]carbamate.

Molecular Properties

Compound Name9H-fluoren-9-ylmethyl N-[2-(hydroxymethyl)phenyl]carbamate
PubChem CID63310501
Molecular FormulaC22H19NO3
Molecular Weight345.40 g/mol
Exact Mass345.14
IUPAC Name9H-fluoren-9-ylmethyl N-[2-(hydroxymethyl)phenyl]carbamate
SMILESO=C(Nc1ccccc1CO)OCC1c2ccccc2-c2ccccc21
InChIInChI=1S/C22H19NO3/c24-13-15-7-1-6-12-21(15)23-22(25)26-14-20-18-10-4-2-8-16(18)17-9-3-5-11-19(17)20/h1-12,20,24H,13-14H2,(H,23,25)
InChIKeyHTYQZDJJJCVONI-UHFFFAOYSA-N
XLogP4.54
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 54.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)benzoic acid
CID 978386
(9H-fluoren-9-yl)methyl N-(3-hydroxyphenyl)carbamate
CID 828288
3-(9-Fluorenylmethyloxycarbonyl)amino-benzoic acid
CID 1501851
9H-fluoren-9-ylmethyl N-(4-selenocyanatophenyl)carbamate
CID 118729597
3-[4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)phenyl]propanoic acid
CID 2755932
2-(4-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)phenyl)acetic acid
CID 2756084
2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-5-methylbenzoic acid
CID 22569032
2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-6-methylbenzoic acid
CID 22569037
3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-2-methylbenzoic acid
CID 22569039
(9H-fluoren-9-yl)methyl N-(2-hydroxyphenyl)carbamate
CID 51340615
(9H-Fluoren-9-yl)methyl (4-(hydroxymethyl)phenyl)carbamate
CID 64795261
N-[2-(9-hydroxy-9H-fluoren-1-yl)phenyl]acetamide
CID 145968182

Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-9-ylmethyl N-[2-(hydroxymethyl)phenyl]carbamate?
The IUPAC name of 9H-fluoren-9-ylmethyl N-[2-(hydroxymethyl)phenyl]carbamate (CID 63310501) is 9H-fluoren-9-ylmethyl N-[2-(hydroxymethyl)phenyl]carbamate.
What is the SMILES notation for 9H-fluoren-9-ylmethyl N-[2-(hydroxymethyl)phenyl]carbamate?
The canonical SMILES for 9H-fluoren-9-ylmethyl N-[2-(hydroxymethyl)phenyl]carbamate is O=C(Nc1ccccc1CO)OCC1c2ccccc2-c2ccccc21.
What is the InChIKey of 9H-fluoren-9-ylmethyl N-[2-(hydroxymethyl)phenyl]carbamate?
The InChIKey is HTYQZDJJJCVONI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19NO3/c24-13-15-7-1-6-12-21(15)23-22(25)26-14-20-18-10-4-2-8-16(18)17-9-3-5-11-19(17)20/h1-12,20,24H,13-14H2,(H,23,25).
What are the key properties of 9H-fluoren-9-ylmethyl N-[2-(hydroxymethyl)phenyl]carbamate?
9H-fluoren-9-ylmethyl N-[2-(hydroxymethyl)phenyl]carbamate has a molecular weight of 345.40 g/mol, XLogP of 4.54, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-fluoren-9-ylmethyl N-[2-(hydroxymethyl)phenyl]carbamate is sourced from PubChem (CID 63310501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).