2-[2-(2-chlorophenyl)ethyl]-9H-fluoren-1-amine

C21H18ClN — CID 151484555

IUPAC2-[2-(2-chlorophenyl)ethyl]-9H-fluoren-1-amine
SMILESNc1c(CCc2ccccc2Cl)ccc2c1Cc1ccccc1-2
InChIInChI=1S/C21H18ClN/c22-20-8-4-2-5-14(20)9-10-15-11-12-18-17-7-3-1-6-16(17)13-19(18)21(15)23/h1-8,11-12H,9-10,13,23H2
InChIKeyPNEFUBMGXJPEOM-UHFFFAOYSA-N
MW319.84 g/mol
LogP5.28
Rot. Bonds3

About 2-[2-(2-chlorophenyl)ethyl]-9H-fluoren-1-amine

2-[2-(2-chlorophenyl)ethyl]-9H-fluoren-1-amine (PubChem CID 151484555) has the molecular formula C21H18ClN and a molecular weight of 319.84 g/mol. Its IUPAC name is 2-[2-(2-chlorophenyl)ethyl]-9H-fluoren-1-amine.

Molecular Properties

Compound Name2-[2-(2-chlorophenyl)ethyl]-9H-fluoren-1-amine
PubChem CID151484555
Molecular FormulaC21H18ClN
Molecular Weight319.84 g/mol
Exact Mass319.11
IUPAC Name2-[2-(2-chlorophenyl)ethyl]-9H-fluoren-1-amine
SMILESNc1c(CCc2ccccc2Cl)ccc2c1Cc1ccccc1-2
InChIInChI=1S/C21H18ClN/c22-20-8-4-2-5-14(20)9-10-15-11-12-18-17-7-3-1-6-16(17)13-19(18)21(15)23/h1-8,11-12H,9-10,13,23H2
InChIKeyPNEFUBMGXJPEOM-UHFFFAOYSA-N
XLogP5.28
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500319.84
LogP ≤ 55.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-9H-fluoren-1-amine
CID 150811433
3-(1-amino-9H-fluoren-2-yl)propanenitrile
CID 152647323
1-chloro-2-[2-(1-chloro-9H-fluoren-2-yl)ethyl]-9H-fluorene;titanium
CID 87867259
1-(1-amino-9H-fluoren-2-yl)ethanone
CID 67094214
4-[1-(4-amino-3-chlorophenyl)-9H-fluoren-2-yl]-2-chloroaniline
CID 18519384
2-[3-(9H-fluoren-1-yl)propanoyloxy]ethyl 3-(9H-fluoren-1-yl)propanoate
CID 160987584
3-(9H-fluoren-1-yl)benzene-1,2-diamine
CID 66643080
2-amino-3-[4-[1-[4-(2-amino-3-hydroxyphenyl)phenyl]-9H-fluoren-2-yl]phenyl]phenol
CID 141049173
1,2-diethyl-9H-fluorene
CID 23440471
2-butyl-1-phenyl-9H-fluorene
CID 154085968
4-[1-(4-aminophenyl)-9H-fluoren-2-yl]aniline
CID 19793996
CID 123562270
CID 123562270

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-chlorophenyl)ethyl]-9H-fluoren-1-amine?
The IUPAC name of 2-[2-(2-chlorophenyl)ethyl]-9H-fluoren-1-amine (CID 151484555) is 2-[2-(2-chlorophenyl)ethyl]-9H-fluoren-1-amine.
What is the SMILES notation for 2-[2-(2-chlorophenyl)ethyl]-9H-fluoren-1-amine?
The canonical SMILES for 2-[2-(2-chlorophenyl)ethyl]-9H-fluoren-1-amine is Nc1c(CCc2ccccc2Cl)ccc2c1Cc1ccccc1-2.
What is the InChIKey of 2-[2-(2-chlorophenyl)ethyl]-9H-fluoren-1-amine?
The InChIKey is PNEFUBMGXJPEOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18ClN/c22-20-8-4-2-5-14(20)9-10-15-11-12-18-17-7-3-1-6-16(17)13-19(18)21(15)23/h1-8,11-12H,9-10,13,23H2.
What are the key properties of 2-[2-(2-chlorophenyl)ethyl]-9H-fluoren-1-amine?
2-[2-(2-chlorophenyl)ethyl]-9H-fluoren-1-amine has a molecular weight of 319.84 g/mol, XLogP of 5.28, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-chlorophenyl)ethyl]-9H-fluoren-1-amine is sourced from PubChem (CID 151484555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).