2-(1,2,3,4,9,9a-hexahydrofluoren-4a-yl)ethanamine

C15H21N — CID 57431239

IUPAC2-(1,2,3,4,9,9a-hexahydrofluoren-4a-yl)ethanamine
SMILESNCCC12CCCCC1Cc1ccccc12
InChIInChI=1S/C15H21N/c16-10-9-15-8-4-3-6-13(15)11-12-5-1-2-7-14(12)15/h1-2,5,7,13H,3-4,6,8-11,16H2
InChIKeyJFGGCYPQBCUEMA-UHFFFAOYSA-N
MW215.34 g/mol
LogP3.02
Rot. Bonds2

About 2-(1,2,3,4,9,9a-hexahydrofluoren-4a-yl)ethanamine

2-(1,2,3,4,9,9a-hexahydrofluoren-4a-yl)ethanamine (PubChem CID 57431239) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is 2-(1,2,3,4,9,9a-hexahydrofluoren-4a-yl)ethanamine.

Molecular Properties

Compound Name2-(1,2,3,4,9,9a-hexahydrofluoren-4a-yl)ethanamine
PubChem CID57431239
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name2-(1,2,3,4,9,9a-hexahydrofluoren-4a-yl)ethanamine
SMILESNCCC12CCCCC1Cc1ccccc12
InChIInChI=1S/C15H21N/c16-10-9-15-8-4-3-6-13(15)11-12-5-1-2-7-14(12)15/h1-2,5,7,13H,3-4,6,8-11,16H2
InChIKeyJFGGCYPQBCUEMA-UHFFFAOYSA-N
XLogP3.02
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[(3aR,8bS)-2,3,3a,4-tetrahydro-1H-cyclopenta[a]inden-8b-yl]butan-2-one
CID 102319492
(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)methanamine
CID 82933231
(1-cyclopropyl-3,4-dihydro-2H-naphthalen-1-yl)methanamine
CID 104819342
(15R)-pentacyclo[13.7.0.01,9.02,7.017,22]docosa-2,4,6,17,19,21-hexaene
CID 171404171
pentacyclo[11.7.0.01,9.02,7.015,20]icosa-2,4,6,15,17,19-hexaene
CID 102574244
(1-cyclohexyl-3,4-dihydro-2H-naphthalen-1-yl)methanol
CID 82944714
3-amino-3-cyclohexyl-1,2-dihydroinden-2-ol
CID 121267977
(4aS,9aR)-4-methyl-1,2,3,4,9,9a-hexahydrofluoren-4a-amine
CID 22841653
N-[(1-cyclopentyl-3,4-dihydro-2H-naphthalen-1-yl)methyl]-2-methylpropan-2-amine
CID 82933323
2-(aminomethyl)-1,2,3,4,9,9a-hexahydrofluoren-4a-amine;dihydrochloride
CID 19106985
2-(2-aminoethyl)spiro[3,4-dihydronaphthalene-1,1'-cyclopentane]-2-ol
CID 19983233
trans-(1R,2R)-2-(2-aminoethyl)-2-(3,4-dichlorophenyl)cyclohexan-1-ol
CID 122473386

Frequently Asked Questions

What is the IUPAC name of 2-(1,2,3,4,9,9a-hexahydrofluoren-4a-yl)ethanamine?
The IUPAC name of 2-(1,2,3,4,9,9a-hexahydrofluoren-4a-yl)ethanamine (CID 57431239) is 2-(1,2,3,4,9,9a-hexahydrofluoren-4a-yl)ethanamine.
What is the SMILES notation for 2-(1,2,3,4,9,9a-hexahydrofluoren-4a-yl)ethanamine?
The canonical SMILES for 2-(1,2,3,4,9,9a-hexahydrofluoren-4a-yl)ethanamine is NCCC12CCCCC1Cc1ccccc12.
What is the InChIKey of 2-(1,2,3,4,9,9a-hexahydrofluoren-4a-yl)ethanamine?
The InChIKey is JFGGCYPQBCUEMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c16-10-9-15-8-4-3-6-13(15)11-12-5-1-2-7-14(12)15/h1-2,5,7,13H,3-4,6,8-11,16H2.
What are the key properties of 2-(1,2,3,4,9,9a-hexahydrofluoren-4a-yl)ethanamine?
2-(1,2,3,4,9,9a-hexahydrofluoren-4a-yl)ethanamine has a molecular weight of 215.34 g/mol, XLogP of 3.02, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2,3,4,9,9a-hexahydrofluoren-4a-yl)ethanamine is sourced from PubChem (CID 57431239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).