9H-fluoren-9-ylmethyl N-(2-hydroxy-2-methylpropyl)carbamate

C19H21NO3 — CID 65109560

IUPAC9H-fluoren-9-ylmethyl N-(2-hydroxy-2-methylpropyl)carbamate
SMILESCC(C)(O)CNC(=O)OCC1c2ccccc2-c2ccccc21
InChIInChI=1S/C19H21NO3/c1-19(2,22)12-20-18(21)23-11-17-15-9-5-3-7-13(15)14-8-4-6-10-16(14)17/h3-10,17,22H,11-12H2,1-2H3,(H,20,21)
InChIKeyXVNYMDIZLJTOAM-UHFFFAOYSA-N
MW311.38 g/mol
LogP3.30
Rot. Bonds4

About 9H-fluoren-9-ylmethyl N-(2-hydroxy-2-methylpropyl)carbamate

9H-fluoren-9-ylmethyl N-(2-hydroxy-2-methylpropyl)carbamate (PubChem CID 65109560) has the molecular formula C19H21NO3 and a molecular weight of 311.38 g/mol. Its IUPAC name is 9H-fluoren-9-ylmethyl N-(2-hydroxy-2-methylpropyl)carbamate.

Molecular Properties

Compound Name9H-fluoren-9-ylmethyl N-(2-hydroxy-2-methylpropyl)carbamate
PubChem CID65109560
Molecular FormulaC19H21NO3
Molecular Weight311.38 g/mol
Exact Mass311.15
IUPAC Name9H-fluoren-9-ylmethyl N-(2-hydroxy-2-methylpropyl)carbamate
SMILESCC(C)(O)CNC(=O)OCC1c2ccccc2-c2ccccc21
InChIInChI=1S/C19H21NO3/c1-19(2,22)12-20-18(21)23-11-17-15-9-5-3-7-13(15)14-8-4-6-10-16(14)17/h3-10,17,22H,11-12H2,1-2H3,(H,20,21)
InChIKeyXVNYMDIZLJTOAM-UHFFFAOYSA-N
XLogP3.30
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.38
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Fmoc-leucine
CID 1549133
(2R)-2-(((9H-fluoren-9-ylmethoxy)carbonyl)amino)-4-methylpentanoic acid
CID 1549477
N-(((9H-Fluoren-9-yl)methoxy)carbonyl)leucine
CID 4308
6-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)hexanoic acid
CID 2756087
N-((9H-fluoren-9-ylmethoxy)carbonyl)-L-valine
CID 100115
FMOC-L-valine
CID 688217
N-((9H-Fluoren-9-ylmethoxy)carbonyl)-L-alanine
CID 6364642
Fmoc-Lys(Boc)-OH
CID 2724628
N-(9H-(2,7-Dimethylfluoren-9-ylmethoxy)carbonyl)leucine
CID 119365
N-Fluorenylmethoxycarbonyl-I2-alanine
CID 2724630
Fmoc-Gly-OH
CID 93124
N-Fmoc-L-isoleucine
CID 2724629

Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-9-ylmethyl N-(2-hydroxy-2-methylpropyl)carbamate?
The IUPAC name of 9H-fluoren-9-ylmethyl N-(2-hydroxy-2-methylpropyl)carbamate (CID 65109560) is 9H-fluoren-9-ylmethyl N-(2-hydroxy-2-methylpropyl)carbamate.
What is the SMILES notation for 9H-fluoren-9-ylmethyl N-(2-hydroxy-2-methylpropyl)carbamate?
The canonical SMILES for 9H-fluoren-9-ylmethyl N-(2-hydroxy-2-methylpropyl)carbamate is CC(C)(O)CNC(=O)OCC1c2ccccc2-c2ccccc21.
What is the InChIKey of 9H-fluoren-9-ylmethyl N-(2-hydroxy-2-methylpropyl)carbamate?
The InChIKey is XVNYMDIZLJTOAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO3/c1-19(2,22)12-20-18(21)23-11-17-15-9-5-3-7-13(15)14-8-4-6-10-16(14)17/h3-10,17,22H,11-12H2,1-2H3,(H,20,21).
What are the key properties of 9H-fluoren-9-ylmethyl N-(2-hydroxy-2-methylpropyl)carbamate?
9H-fluoren-9-ylmethyl N-(2-hydroxy-2-methylpropyl)carbamate has a molecular weight of 311.38 g/mol, XLogP of 3.30, 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-hydroxy-2-methylpropyl)carbamate is sourced from PubChem (CID 65109560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).