N-(3-methoxy-2-methylpropyl)-9H-fluoren-2-amine

C18H21NO — CID 116500708

IUPACN-(3-methoxy-2-methylpropyl)-9H-fluoren-2-amine
SMILESCOCC(C)CNc1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C18H21NO/c1-13(12-20-2)11-19-16-7-8-18-15(10-16)9-14-5-3-4-6-17(14)18/h3-8,10,13,19H,9,11-12H2,1-2H3
InChIKeyGPDUJZOIKRSQIL-UHFFFAOYSA-N
MW267.37 g/mol
LogP3.95
Rot. Bonds5

About N-(3-methoxy-2-methylpropyl)-9H-fluoren-2-amine

N-(3-methoxy-2-methylpropyl)-9H-fluoren-2-amine (PubChem CID 116500708) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is N-(3-methoxy-2-methylpropyl)-9H-fluoren-2-amine.

Molecular Properties

Compound NameN-(3-methoxy-2-methylpropyl)-9H-fluoren-2-amine
PubChem CID116500708
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC NameN-(3-methoxy-2-methylpropyl)-9H-fluoren-2-amine
SMILESCOCC(C)CNc1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C18H21NO/c1-13(12-20-2)11-19-16-7-8-18-15(10-16)9-14-5-3-4-6-17(14)18/h3-8,10,13,19H,9,11-12H2,1-2H3
InChIKeyGPDUJZOIKRSQIL-UHFFFAOYSA-N
XLogP3.95
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(3-methoxy-2-methylpropyl)-9H-fluoren-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxy-2-methylpropyl)-9H-fluoren-2-amine?
The IUPAC name of N-(3-methoxy-2-methylpropyl)-9H-fluoren-2-amine (CID 116500708) is N-(3-methoxy-2-methylpropyl)-9H-fluoren-2-amine.
What is the SMILES notation for N-(3-methoxy-2-methylpropyl)-9H-fluoren-2-amine?
The canonical SMILES for N-(3-methoxy-2-methylpropyl)-9H-fluoren-2-amine is COCC(C)CNc1ccc2c(c1)Cc1ccccc1-2.
What is the InChIKey of N-(3-methoxy-2-methylpropyl)-9H-fluoren-2-amine?
The InChIKey is GPDUJZOIKRSQIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-13(12-20-2)11-19-16-7-8-18-15(10-16)9-14-5-3-4-6-17(14)18/h3-8,10,13,19H,9,11-12H2,1-2H3.
What are the key properties of N-(3-methoxy-2-methylpropyl)-9H-fluoren-2-amine?
N-(3-methoxy-2-methylpropyl)-9H-fluoren-2-amine has a molecular weight of 267.37 g/mol, XLogP of 3.95, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxy-2-methylpropyl)-9H-fluoren-2-amine is sourced from PubChem (CID 116500708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).