(1E)-1-ethylidene-3-methyl-2-methylidene-4-phenyl-6-propan-2-ylnaphthalene

C23H24 — CID 145276200

IUPAC(1E)-1-ethylidene-3-methyl-2-methylidene-4-phenyl-6-propan-2-ylnaphthalene
SMILESC=c1c(C)c(-c2ccccc2)c2cc(C(C)C)ccc2/c1=C/C
InChIInChI=1S/C23H24/c1-6-20-16(4)17(5)23(18-10-8-7-9-11-18)22-14-19(15(2)3)12-13-21(20)22/h6-15H,4H2,1-3,5H3/b20-6+
InChIKeyKITIWZKCQPBRMH-CGOBSMCZSA-N
MW300.44 g/mol
LogP5.15
Rot. Bonds2

About (1E)-1-ethylidene-3-methyl-2-methylidene-4-phenyl-6-propan-2-ylnaphthalene

(1E)-1-ethylidene-3-methyl-2-methylidene-4-phenyl-6-propan-2-ylnaphthalene (PubChem CID 145276200) has the molecular formula C23H24 and a molecular weight of 300.44 g/mol. Its IUPAC name is (1E)-1-ethylidene-3-methyl-2-methylidene-4-phenyl-6-propan-2-ylnaphthalene.

Molecular Properties

Compound Name(1E)-1-ethylidene-3-methyl-2-methylidene-4-phenyl-6-propan-2-ylnaphthalene
PubChem CID145276200
Molecular FormulaC23H24
Molecular Weight300.44 g/mol
Exact Mass300.19
IUPAC Name(1E)-1-ethylidene-3-methyl-2-methylidene-4-phenyl-6-propan-2-ylnaphthalene
SMILESC=c1c(C)c(-c2ccccc2)c2cc(C(C)C)ccc2/c1=C/C
InChIInChI=1S/C23H24/c1-6-20-16(4)17(5)23(18-10-8-7-9-11-18)22-14-19(15(2)3)12-13-21(20)22/h6-15H,4H2,1-3,5H3/b20-6+
InChIKeyKITIWZKCQPBRMH-CGOBSMCZSA-N
XLogP5.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.44
LogP ≤ 55.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4-methyl-1-phenyl-6-propan-2-ylnaphthalene
CID 157491424
9,10-dimethyl-2-propan-2-ylphenanthrene
CID 140734876
2-(9-methyl-10-phenylphenanthren-2-yl)-4-propan-2-ylpyridine
CID 164792300
6-N,16-N-bis(2-methyl-5-propan-2-ylphenyl)-3,10,13,20-tetraphenyl-6-N,16-N-bis(3-phenylphenyl)pentacyclo[10.8.0.02,11.04,9.014,19]icosa-1(20),2,4(9),5,7,10,12,14(19),15,17-decaene-6,16-diamine
CID 166032949
5-(4-tert-butylphenyl)-2,8-dimethyl-6,12-diphenyl-11-(4-propan-2-ylphenyl)tetracene
CID 162426485
9-phenyl-10-[3-[3-[4-(4-propan-2-ylphenyl)phenyl]phenyl]phenyl]anthracene
CID 123974546
(9E)-9-ethylidene-10-methylidenephenanthrene
CID 142424633
5,6,11,12-tetrakis(4-tert-butylphenyl)-2,8-di(propan-2-yl)tetracene
CID 162426419
1-[4-(9,10-diphenyl-6-propan-2-ylanthracen-2-yl)phenyl]-2-phenylbenzimidazole
CID 58953696
2-N,6-N-dinaphthalen-2-yl-9,10-diphenyl-2-N,6-N-bis(4-propan-2-ylphenyl)anthracene-2,6-diamine
CID 143986181
2-tert-butyl-5,6,11,12-tetrakis(4-methylphenyl)-8-propan-2-yltetracene
CID 162426516
2-N-(4-methylphenyl)-2-N,6-N-bis(3-methyl-5-propan-2-ylphenyl)-6-N,9,10-triphenylanthracene-2,6-diamine
CID 143986348

Frequently Asked Questions

What is the IUPAC name of (1E)-1-ethylidene-3-methyl-2-methylidene-4-phenyl-6-propan-2-ylnaphthalene?
The IUPAC name of (1E)-1-ethylidene-3-methyl-2-methylidene-4-phenyl-6-propan-2-ylnaphthalene (CID 145276200) is (1E)-1-ethylidene-3-methyl-2-methylidene-4-phenyl-6-propan-2-ylnaphthalene.
What is the SMILES notation for (1E)-1-ethylidene-3-methyl-2-methylidene-4-phenyl-6-propan-2-ylnaphthalene?
The canonical SMILES for (1E)-1-ethylidene-3-methyl-2-methylidene-4-phenyl-6-propan-2-ylnaphthalene is C=c1c(C)c(-c2ccccc2)c2cc(C(C)C)ccc2/c1=C/C.
What is the InChIKey of (1E)-1-ethylidene-3-methyl-2-methylidene-4-phenyl-6-propan-2-ylnaphthalene?
The InChIKey is KITIWZKCQPBRMH-CGOBSMCZSA-N. The full InChI is InChI=1S/C23H24/c1-6-20-16(4)17(5)23(18-10-8-7-9-11-18)22-14-19(15(2)3)12-13-21(20)22/h6-15H,4H2,1-3,5H3/b20-6+.
What are the key properties of (1E)-1-ethylidene-3-methyl-2-methylidene-4-phenyl-6-propan-2-ylnaphthalene?
(1E)-1-ethylidene-3-methyl-2-methylidene-4-phenyl-6-propan-2-ylnaphthalene has a molecular weight of 300.44 g/mol, XLogP of 5.15, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1E)-1-ethylidene-3-methyl-2-methylidene-4-phenyl-6-propan-2-ylnaphthalene is sourced from PubChem (CID 145276200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).