1-(3-ethylcyclohexyl)-4-methyl-3,4-dihydro-2H-naphthalen-1-amine

C19H29N — CID 115419750

IUPAC1-(3-ethylcyclohexyl)-4-methyl-3,4-dihydro-2H-naphthalen-1-amine
SMILESCCC1CCCC(C2(N)CCC(C)c3ccccc32)C1
InChIInChI=1S/C19H29N/c1-3-15-7-6-8-16(13-15)19(20)12-11-14(2)17-9-4-5-10-18(17)19/h4-5,9-10,14-16H,3,6-8,11-13,20H2,1-2H3
InChIKeyBDFOZGGMUMGVGV-UHFFFAOYSA-N
MW271.45 g/mol
LogP4.95
Rot. Bonds2

About 1-(3-ethylcyclohexyl)-4-methyl-3,4-dihydro-2H-naphthalen-1-amine

1-(3-ethylcyclohexyl)-4-methyl-3,4-dihydro-2H-naphthalen-1-amine (PubChem CID 115419750) has the molecular formula C19H29N and a molecular weight of 271.45 g/mol. Its IUPAC name is 1-(3-ethylcyclohexyl)-4-methyl-3,4-dihydro-2H-naphthalen-1-amine.

Molecular Properties

Compound Name1-(3-ethylcyclohexyl)-4-methyl-3,4-dihydro-2H-naphthalen-1-amine
PubChem CID115419750
Molecular FormulaC19H29N
Molecular Weight271.45 g/mol
Exact Mass271.23
IUPAC Name1-(3-ethylcyclohexyl)-4-methyl-3,4-dihydro-2H-naphthalen-1-amine
SMILESCCC1CCCC(C2(N)CCC(C)c3ccccc32)C1
InChIInChI=1S/C19H29N/c1-3-15-7-6-8-16(13-15)19(20)12-11-14(2)17-9-4-5-10-18(17)19/h4-5,9-10,14-16H,3,6-8,11-13,20H2,1-2H3
InChIKeyBDFOZGGMUMGVGV-UHFFFAOYSA-N
XLogP4.95
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.45
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(aminomethyl)-N-ethyl-N,4-dimethyl-3,4-dihydro-2H-naphthalen-1-amine
CID 113305935
(1R,4R)-4-ethyl-1,4-dimethyl-2,3-dihydro-1H-naphthalene
CID 97103179
1-(aminomethyl)-N-cyclohexyl-N,4-dimethyl-3,4-dihydro-2H-naphthalen-1-amine
CID 115418589
1-hexyl-4-methyl-3,4-dihydro-2H-naphthalen-1-amine
CID 115419755
1-(aminomethyl)-4-methyl-3,4-dihydro-2H-naphthalen-1-ol
CID 115419502
1-[1-(aminomethyl)-3-methylcyclohexyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-ol
CID 115420935
4-methyl-1-(pyridin-2-ylmethyl)-3,4-dihydro-2H-naphthalen-1-amine
CID 115419894
1-(3-ethylcyclohexyl)-3,4-dimethylcyclohexan-1-amine
CID 64733394
1-(3-ethylsulfonylpropyl)-4-methyl-3,4-dihydro-2H-naphthalen-1-amine
CID 115419809
N-(3-ethylcyclohexyl)-2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-amine
CID 115532119
1-(aminomethyl)-N,4-dimethyl-N-(oxolan-2-ylmethyl)-3,4-dihydro-2H-naphthalen-1-amine
CID 115418640
4-methyl-1-pentyl-3,4-dihydro-2H-naphthalen-1-ol
CID 115419566

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethylcyclohexyl)-4-methyl-3,4-dihydro-2H-naphthalen-1-amine?
The IUPAC name of 1-(3-ethylcyclohexyl)-4-methyl-3,4-dihydro-2H-naphthalen-1-amine (CID 115419750) is 1-(3-ethylcyclohexyl)-4-methyl-3,4-dihydro-2H-naphthalen-1-amine.
What is the SMILES notation for 1-(3-ethylcyclohexyl)-4-methyl-3,4-dihydro-2H-naphthalen-1-amine?
The canonical SMILES for 1-(3-ethylcyclohexyl)-4-methyl-3,4-dihydro-2H-naphthalen-1-amine is CCC1CCCC(C2(N)CCC(C)c3ccccc32)C1.
What is the InChIKey of 1-(3-ethylcyclohexyl)-4-methyl-3,4-dihydro-2H-naphthalen-1-amine?
The InChIKey is BDFOZGGMUMGVGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N/c1-3-15-7-6-8-16(13-15)19(20)12-11-14(2)17-9-4-5-10-18(17)19/h4-5,9-10,14-16H,3,6-8,11-13,20H2,1-2H3.
What are the key properties of 1-(3-ethylcyclohexyl)-4-methyl-3,4-dihydro-2H-naphthalen-1-amine?
1-(3-ethylcyclohexyl)-4-methyl-3,4-dihydro-2H-naphthalen-1-amine has a molecular weight of 271.45 g/mol, XLogP of 4.95, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethylcyclohexyl)-4-methyl-3,4-dihydro-2H-naphthalen-1-amine is sourced from PubChem (CID 115419750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).