9H-fluoren-9-ylmethyl N-(3-hydroxypropyl)carbamate

C18H19NO3 — CID 2736488

IUPAC9H-fluoren-9-ylmethyl N-(3-hydroxypropyl)carbamate
SMILESO=C(NCCCO)OCC1c2ccccc2-c2ccccc21
InChIInChI=1S/C18H19NO3/c20-11-5-10-19-18(21)22-12-17-15-8-3-1-6-13(15)14-7-2-4-9-16(14)17/h1-4,6-9,17,20H,5,10-12H2,(H,19,21)
InChIKeyGNXZNUJDAMSJFZ-UHFFFAOYSA-N
MW297.35 g/mol
LogP2.91
Rot. Bonds5

About 9H-fluoren-9-ylmethyl N-(3-hydroxypropyl)carbamate

9H-fluoren-9-ylmethyl N-(3-hydroxypropyl)carbamate (PubChem CID 2736488) has the molecular formula C18H19NO3 and a molecular weight of 297.35 g/mol. Its IUPAC name is 9H-fluoren-9-ylmethyl N-(3-hydroxypropyl)carbamate.

Molecular Properties

Compound Name9H-fluoren-9-ylmethyl N-(3-hydroxypropyl)carbamate
PubChem CID2736488
Molecular FormulaC18H19NO3
Molecular Weight297.35 g/mol
Exact Mass297.14
IUPAC Name9H-fluoren-9-ylmethyl N-(3-hydroxypropyl)carbamate
SMILESO=C(NCCCO)OCC1c2ccccc2-c2ccccc21
InChIInChI=1S/C18H19NO3/c20-11-5-10-19-18(21)22-12-17-15-8-3-1-6-13(15)14-7-2-4-9-16(14)17/h1-4,6-9,17,20H,5,10-12H2,(H,19,21)
InChIKeyGNXZNUJDAMSJFZ-UHFFFAOYSA-N
XLogP2.91
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.35
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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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
N-Fluorenylmethoxycarbonyl-I2-alanine
CID 2724630
Fmoc-Gly-OH
CID 93124
N-Fmoc-L-isoleucine
CID 2724629
2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanoic acid
CID 100108
(2R)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-methylbutanoic acid
CID 1549479

Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-9-ylmethyl N-(3-hydroxypropyl)carbamate?
The IUPAC name of 9H-fluoren-9-ylmethyl N-(3-hydroxypropyl)carbamate (CID 2736488) is 9H-fluoren-9-ylmethyl N-(3-hydroxypropyl)carbamate.
What is the SMILES notation for 9H-fluoren-9-ylmethyl N-(3-hydroxypropyl)carbamate?
The canonical SMILES for 9H-fluoren-9-ylmethyl N-(3-hydroxypropyl)carbamate is O=C(NCCCO)OCC1c2ccccc2-c2ccccc21.
What is the InChIKey of 9H-fluoren-9-ylmethyl N-(3-hydroxypropyl)carbamate?
The InChIKey is GNXZNUJDAMSJFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO3/c20-11-5-10-19-18(21)22-12-17-15-8-3-1-6-13(15)14-7-2-4-9-16(14)17/h1-4,6-9,17,20H,5,10-12H2,(H,19,21).
What are the key properties of 9H-fluoren-9-ylmethyl N-(3-hydroxypropyl)carbamate?
9H-fluoren-9-ylmethyl N-(3-hydroxypropyl)carbamate has a molecular weight of 297.35 g/mol, XLogP of 2.91, 5 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-(3-hydroxypropyl)carbamate is sourced from PubChem (CID 2736488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).