4-methylidene-5-propan-2-yl-2,3-dihydro-1H-naphthalene

C14H18 — CID 165077411

IUPAC4-methylidene-5-propan-2-yl-2,3-dihydro-1H-naphthalene
SMILESC=C1CCCc2cccc(C(C)C)c21
InChIInChI=1S/C14H18/c1-10(2)13-9-5-8-12-7-4-6-11(3)14(12)13/h5,8-10H,3-4,6-7H2,1-2H3
InChIKeyLWDKLKDPTFTXDU-UHFFFAOYSA-N
MW186.30 g/mol
LogP4.16
Rot. Bonds1

About 4-methylidene-5-propan-2-yl-2,3-dihydro-1H-naphthalene

4-methylidene-5-propan-2-yl-2,3-dihydro-1H-naphthalene (PubChem CID 165077411) has the molecular formula C14H18 and a molecular weight of 186.30 g/mol. Its IUPAC name is 4-methylidene-5-propan-2-yl-2,3-dihydro-1H-naphthalene.

Molecular Properties

Compound Name4-methylidene-5-propan-2-yl-2,3-dihydro-1H-naphthalene
PubChem CID165077411
Molecular FormulaC14H18
Molecular Weight186.30 g/mol
Exact Mass186.14
IUPAC Name4-methylidene-5-propan-2-yl-2,3-dihydro-1H-naphthalene
SMILESC=C1CCCc2cccc(C(C)C)c21
InChIInChI=1S/C14H18/c1-10(2)13-9-5-8-12-7-4-6-11(3)14(12)13/h5,8-10H,3-4,6-7H2,1-2H3
InChIKeyLWDKLKDPTFTXDU-UHFFFAOYSA-N
XLogP4.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 4-methylidene-5-propan-2-yl-2,3-dihydro-1H-naphthalene?
The IUPAC name of 4-methylidene-5-propan-2-yl-2,3-dihydro-1H-naphthalene (CID 165077411) is 4-methylidene-5-propan-2-yl-2,3-dihydro-1H-naphthalene.
What is the SMILES notation for 4-methylidene-5-propan-2-yl-2,3-dihydro-1H-naphthalene?
The canonical SMILES for 4-methylidene-5-propan-2-yl-2,3-dihydro-1H-naphthalene is C=C1CCCc2cccc(C(C)C)c21.
What is the InChIKey of 4-methylidene-5-propan-2-yl-2,3-dihydro-1H-naphthalene?
The InChIKey is LWDKLKDPTFTXDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18/c1-10(2)13-9-5-8-12-7-4-6-11(3)14(12)13/h5,8-10H,3-4,6-7H2,1-2H3.
What are the key properties of 4-methylidene-5-propan-2-yl-2,3-dihydro-1H-naphthalene?
4-methylidene-5-propan-2-yl-2,3-dihydro-1H-naphthalene has a molecular weight of 186.30 g/mol, XLogP of 4.16, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylidene-5-propan-2-yl-2,3-dihydro-1H-naphthalene is sourced from PubChem (CID 165077411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).