2,3-dihydro-1H-inden-1-yl-(3-ethylcyclohexyl)methanamine

C18H27N — CID 65406297

IUPAC2,3-dihydro-1H-inden-1-yl-(3-ethylcyclohexyl)methanamine
SMILESCCC1CCCC(C(N)C2CCc3ccccc32)C1
InChIInChI=1S/C18H27N/c1-2-13-6-5-8-15(12-13)18(19)17-11-10-14-7-3-4-9-16(14)17/h3-4,7,9,13,15,17-18H,2,5-6,8,10-12,19H2,1H3
InChIKeyDNLKQUBXNQLBMO-UHFFFAOYSA-N
MW257.42 g/mol
LogP4.26
Rot. Bonds3

About 2,3-dihydro-1H-inden-1-yl-(3-ethylcyclohexyl)methanamine

2,3-dihydro-1H-inden-1-yl-(3-ethylcyclohexyl)methanamine (PubChem CID 65406297) has the molecular formula C18H27N and a molecular weight of 257.42 g/mol. Its IUPAC name is 2,3-dihydro-1H-inden-1-yl-(3-ethylcyclohexyl)methanamine.

Molecular Properties

Compound Name2,3-dihydro-1H-inden-1-yl-(3-ethylcyclohexyl)methanamine
PubChem CID65406297
Molecular FormulaC18H27N
Molecular Weight257.42 g/mol
Exact Mass257.21
IUPAC Name2,3-dihydro-1H-inden-1-yl-(3-ethylcyclohexyl)methanamine
SMILESCCC1CCCC(C(N)C2CCc3ccccc32)C1
InChIInChI=1S/C18H27N/c1-2-13-6-5-8-15(12-13)18(19)17-11-10-14-7-3-4-9-16(14)17/h3-4,7,9,13,15,17-18H,2,5-6,8,10-12,19H2,1H3
InChIKeyDNLKQUBXNQLBMO-UHFFFAOYSA-N
XLogP4.26
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.42
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-cyclopentyl-1-(2,3-dihydro-1H-inden-1-yl)ethanamine
CID 65405512
N-[7-bicyclo[4.2.0]octa-1,3,5-trienyl-(3-ethylcyclohexyl)methyl]ethanamine
CID 64984610
2-cyclopropyl-1-(2,3-dihydro-1H-inden-1-yl)ethanamine
CID 65403573
[2,3-dihydro-1H-inden-1-yl-(2-ethylcyclohexyl)methyl]hydrazine
CID 105234438
1-(2,3-dihydro-1H-inden-1-yl)ethanamine
CID 23332534
1-(2,3-dihydro-1H-inden-1-yl)propan-1-ol
CID 18690782
3-(3-ethylcyclohexyl)-1-phenylpropan-1-amine
CID 64505370
(1R)-1-propan-2-yl-2,3-dihydro-1H-indene
CID 59961726
N-(3-ethylcyclohexyl)-2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-amine
CID 115532119
[1-(2,3-dihydro-1H-inden-1-yl)-2-methylbutyl]hydrazine
CID 105234483
(1,4-dimethylpiperazin-2-yl)-(3-ethylcyclohexyl)methanamine
CID 79658674
1-(2,3-dihydro-1H-inden-1-yl)undecan-1-amine
CID 65403955

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-inden-1-yl-(3-ethylcyclohexyl)methanamine?
The IUPAC name of 2,3-dihydro-1H-inden-1-yl-(3-ethylcyclohexyl)methanamine (CID 65406297) is 2,3-dihydro-1H-inden-1-yl-(3-ethylcyclohexyl)methanamine.
What is the SMILES notation for 2,3-dihydro-1H-inden-1-yl-(3-ethylcyclohexyl)methanamine?
The canonical SMILES for 2,3-dihydro-1H-inden-1-yl-(3-ethylcyclohexyl)methanamine is CCC1CCCC(C(N)C2CCc3ccccc32)C1.
What is the InChIKey of 2,3-dihydro-1H-inden-1-yl-(3-ethylcyclohexyl)methanamine?
The InChIKey is DNLKQUBXNQLBMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N/c1-2-13-6-5-8-15(12-13)18(19)17-11-10-14-7-3-4-9-16(14)17/h3-4,7,9,13,15,17-18H,2,5-6,8,10-12,19H2,1H3.
What are the key properties of 2,3-dihydro-1H-inden-1-yl-(3-ethylcyclohexyl)methanamine?
2,3-dihydro-1H-inden-1-yl-(3-ethylcyclohexyl)methanamine has a molecular weight of 257.42 g/mol, XLogP of 4.26, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-inden-1-yl-(3-ethylcyclohexyl)methanamine is sourced from PubChem (CID 65406297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).