2-methyl-2-(4-phenylphenyl)cyclopropane-1-carbonitrile

C17H15N — CID 116841830

IUPAC2-methyl-2-(4-phenylphenyl)cyclopropane-1-carbonitrile
SMILESCC1(c2ccc(-c3ccccc3)cc2)CC1C#N
InChIInChI=1S/C17H15N/c1-17(11-16(17)12-18)15-9-7-14(8-10-15)13-5-3-2-4-6-13/h2-10,16H,11H2,1H3
InChIKeyRGYXOOYVDUAJGE-UHFFFAOYSA-N
MW233.31 g/mol
LogP4.15
Rot. Bonds2

About 2-methyl-2-(4-phenylphenyl)cyclopropane-1-carbonitrile

2-methyl-2-(4-phenylphenyl)cyclopropane-1-carbonitrile (PubChem CID 116841830) has the molecular formula C17H15N and a molecular weight of 233.31 g/mol. Its IUPAC name is 2-methyl-2-(4-phenylphenyl)cyclopropane-1-carbonitrile.

Molecular Properties

Compound Name2-methyl-2-(4-phenylphenyl)cyclopropane-1-carbonitrile
PubChem CID116841830
Molecular FormulaC17H15N
Molecular Weight233.31 g/mol
Exact Mass233.12
IUPAC Name2-methyl-2-(4-phenylphenyl)cyclopropane-1-carbonitrile
SMILESCC1(c2ccc(-c3ccccc3)cc2)CC1C#N
InChIInChI=1S/C17H15N/c1-17(11-16(17)12-18)15-9-7-14(8-10-15)13-5-3-2-4-6-13/h2-10,16H,11H2,1H3
InChIKeyRGYXOOYVDUAJGE-UHFFFAOYSA-N
XLogP4.15
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

cis-(1S,2R)-2-methyl-2-phenylcyclopropane-1-carbonitrile
CID 6427547
2-methyl-2-(4-propan-2-yloxyphenyl)cyclopropane-1-carbonitrile
CID 116841843
trans-(1S,2S)-N,N,2-trimethyl-2-(4-phenylphenyl)cyclopropane-1-carboxamide
CID 102346584
2-fluoro-2-phenylcyclopropane-1-carbonitrile
CID 102180676
2-methyl-2-naphthalen-2-ylcyclobutane-1-carbonitrile
CID 172635798
bis(acetonitrile);1,1'-biphenyl
CID 175366291
2-(4-phenylphenyl)cyclopropane-1,1-dicarbonitrile
CID 156779666
1-(3-chloro-1-methylcyclopentyl)-4-phenylbenzene
CID 116540324
3-methyl-3-(4-phenylphenyl)cyclopentan-1-amine
CID 116538694
cis-(1R,2S)-2-methyl-2-phenylcyclopropan-1-ol
CID 121227035
3-hydroxy-6-methyl-3,6-diphenyldioxane-4-carbonitrile
CID 15324080
5,5-dimethyl-3-phenylcyclohex-2-en-1-amine
CID 65176854

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(4-phenylphenyl)cyclopropane-1-carbonitrile?
The IUPAC name of 2-methyl-2-(4-phenylphenyl)cyclopropane-1-carbonitrile (CID 116841830) is 2-methyl-2-(4-phenylphenyl)cyclopropane-1-carbonitrile.
What is the SMILES notation for 2-methyl-2-(4-phenylphenyl)cyclopropane-1-carbonitrile?
The canonical SMILES for 2-methyl-2-(4-phenylphenyl)cyclopropane-1-carbonitrile is CC1(c2ccc(-c3ccccc3)cc2)CC1C#N.
What is the InChIKey of 2-methyl-2-(4-phenylphenyl)cyclopropane-1-carbonitrile?
The InChIKey is RGYXOOYVDUAJGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N/c1-17(11-16(17)12-18)15-9-7-14(8-10-15)13-5-3-2-4-6-13/h2-10,16H,11H2,1H3.
What are the key properties of 2-methyl-2-(4-phenylphenyl)cyclopropane-1-carbonitrile?
2-methyl-2-(4-phenylphenyl)cyclopropane-1-carbonitrile has a molecular weight of 233.31 g/mol, XLogP of 4.15, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(4-phenylphenyl)cyclopropane-1-carbonitrile is sourced from PubChem (CID 116841830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).