1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene

C14H20 — CID 54453127

IUPAC1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene
SMILESCC(C)CC1CCCc2ccccc21
InChIInChI=1S/C14H20/c1-11(2)10-13-8-5-7-12-6-3-4-9-14(12)13/h3-4,6,9,11,13H,5,7-8,10H2,1-2H3
InChIKeyWWIASMBZYOCWQO-UHFFFAOYSA-N
MW188.31 g/mol
LogP4.15
Rot. Bonds2

About 1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene

1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene (PubChem CID 54453127) has the molecular formula C14H20 and a molecular weight of 188.31 g/mol. Its IUPAC name is 1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene
PubChem CID54453127
Molecular FormulaC14H20
Molecular Weight188.31 g/mol
Exact Mass188.16
IUPAC Name1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene
SMILESCC(C)CC1CCCc2ccccc21
InChIInChI=1S/C14H20/c1-11(2)10-13-8-5-7-12-6-3-4-9-14(12)13/h3-4,6,9,11,13H,5,7-8,10H2,1-2H3
InChIKeyWWIASMBZYOCWQO-UHFFFAOYSA-N
XLogP4.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]-1,2,3,4-tetrahydronaphthalene
CID 15742901
3-methoxy-1-(1,2,3,4-tetrahydronaphthalen-1-yl)butan-2-ol
CID 79616532
3-phenyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)butan-2-ol
CID 63902024
2-methyl-4-(1,2,3,4-tetrahydronaphthalen-1-yl)butanal
CID 64663678
1-(iodomethyl)-1,2,3,4-tetrahydronaphthalene
CID 2763030
1-(bromomethyl)-1,2,3,4-tetrahydronaphthalene
CID 13067239
(1R)-1-prop-2-enyl-1,2,3,4-tetrahydronaphthalene
CID 138977422
1-(2-methylcyclopropyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 65420172
2,3-dimethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)butan-2-ol
CID 63770918
1-methoxy-3-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-2-amine
CID 63772832
N,3,3-trimethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-2-amine
CID 115812436
[3-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-2-yl]hydrazine
CID 105219620

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene (CID 54453127) is 1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene is CC(C)CC1CCCc2ccccc21.
What is the InChIKey of 1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene?
The InChIKey is WWIASMBZYOCWQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20/c1-11(2)10-13-8-5-7-12-6-3-4-9-14(12)13/h3-4,6,9,11,13H,5,7-8,10H2,1-2H3.
What are the key properties of 1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene?
1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene has a molecular weight of 188.31 g/mol, XLogP of 4.15, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 54453127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).