9H-fluoren-9-ylmethyl-[2-(2-hydroxyethoxy)ethyl]carbamic acid

C19H21NO4 — CID 118902712

IUPAC9H-fluoren-9-ylmethyl-[2-(2-hydroxyethoxy)ethyl]carbamic acid
SMILESO=C(O)N(CCOCCO)CC1c2ccccc2-c2ccccc21
InChIInChI=1S/C19H21NO4/c21-10-12-24-11-9-20(19(22)23)13-18-16-7-3-1-5-14(16)15-6-2-4-8-17(15)18/h1-8,18,21H,9-13H2,(H,22,23)
InChIKeyUFKHVHPQJLNPMM-UHFFFAOYSA-N
MW327.38 g/mol
LogP2.79
Rot. Bonds7

About 9H-fluoren-9-ylmethyl-[2-(2-hydroxyethoxy)ethyl]carbamic acid

9H-fluoren-9-ylmethyl-[2-(2-hydroxyethoxy)ethyl]carbamic acid (PubChem CID 118902712) has the molecular formula C19H21NO4 and a molecular weight of 327.38 g/mol. Its IUPAC name is 9H-fluoren-9-ylmethyl-[2-(2-hydroxyethoxy)ethyl]carbamic acid.

Molecular Properties

Compound Name9H-fluoren-9-ylmethyl-[2-(2-hydroxyethoxy)ethyl]carbamic acid
PubChem CID118902712
Molecular FormulaC19H21NO4
Molecular Weight327.38 g/mol
Exact Mass327.15
IUPAC Name9H-fluoren-9-ylmethyl-[2-(2-hydroxyethoxy)ethyl]carbamic acid
SMILESO=C(O)N(CCOCCO)CC1c2ccccc2-c2ccccc21
InChIInChI=1S/C19H21NO4/c21-10-12-24-11-9-20(19(22)23)13-18-16-7-3-1-5-14(16)15-6-2-4-8-17(15)18/h1-8,18,21H,9-13H2,(H,22,23)
InChIKeyUFKHVHPQJLNPMM-UHFFFAOYSA-N
XLogP2.79
TPSA70.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.38
LogP ≤ 52.79
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

3-[2-[2-(3-aminopropoxy)ethoxy]ethoxy]propyl-(9H-fluoren-9-ylmethyl)carbamic acid;hydrochloride
CID 121333145
9H-fluoren-9-ylmethyl N-[2-(2-hydroxyethoxy)ethyl]-N-[2-(methylcarbamoyloxy)ethyl]carbamate
CID 178159554
9H-fluoren-9-ylmethyl N,N-bis[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethyl]carbamate
CID 178135145
9H-fluoren-9-ylmethyl N-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]carbamate
CID 17039577
9H-fluoren-9-ylmethyl N-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]carbamate
CID 134528524
2-[9H-fluoren-9-ylmethoxycarbonyl(2-phenylmethoxyethyl)amino]acetic acid
CID 101481949
9H-fluoren-9-ylmethyl 2-hydroxyethyl carbonate
CID 174872937
2-[9H-fluoren-9-ylmethoxycarbonyl-[2-[2-(methylamino)ethoxy]ethyl]amino]acetic acid
CID 156691934
N-(2-cyanoethyl)-N-[2-(2-hydroxyethoxy)ethyl]benzamide
CID 57306314
2-[N-[2-(2-hydroxyethoxy)ethyl]anilino]acetic acid
CID 61070339
benzoic acid;2-(2-hydroxyethoxy)ethanol
CID 57375611
3-[2-[2-[2-[2-[9H-fluoren-9-yl(methoxycarbonyl)amino]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
CID 67304548

Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-9-ylmethyl-[2-(2-hydroxyethoxy)ethyl]carbamic acid?
The IUPAC name of 9H-fluoren-9-ylmethyl-[2-(2-hydroxyethoxy)ethyl]carbamic acid (CID 118902712) is 9H-fluoren-9-ylmethyl-[2-(2-hydroxyethoxy)ethyl]carbamic acid.
What is the SMILES notation for 9H-fluoren-9-ylmethyl-[2-(2-hydroxyethoxy)ethyl]carbamic acid?
The canonical SMILES for 9H-fluoren-9-ylmethyl-[2-(2-hydroxyethoxy)ethyl]carbamic acid is O=C(O)N(CCOCCO)CC1c2ccccc2-c2ccccc21.
What is the InChIKey of 9H-fluoren-9-ylmethyl-[2-(2-hydroxyethoxy)ethyl]carbamic acid?
The InChIKey is UFKHVHPQJLNPMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO4/c21-10-12-24-11-9-20(19(22)23)13-18-16-7-3-1-5-14(16)15-6-2-4-8-17(15)18/h1-8,18,21H,9-13H2,(H,22,23).
What are the key properties of 9H-fluoren-9-ylmethyl-[2-(2-hydroxyethoxy)ethyl]carbamic acid?
9H-fluoren-9-ylmethyl-[2-(2-hydroxyethoxy)ethyl]carbamic acid has a molecular weight of 327.38 g/mol, XLogP of 2.79, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-fluoren-9-ylmethyl-[2-(2-hydroxyethoxy)ethyl]carbamic acid is sourced from PubChem (CID 118902712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).