(2-chlorophenyl)-(1-phenylcyclopropyl)methanone

C16H13ClO — CID 63080543

IUPAC(2-chlorophenyl)-(1-phenylcyclopropyl)methanone
SMILESO=C(c1ccccc1Cl)C1(c2ccccc2)CC1
InChIInChI=1S/C16H13ClO/c17-14-9-5-4-8-13(14)15(18)16(10-11-16)12-6-2-1-3-7-12/h1-9H,10-11H2
InChIKeyRVHMYMBMFNFCEA-UHFFFAOYSA-N
MW256.73 g/mol
LogP4.25
Rot. Bonds3

About (2-chlorophenyl)-(1-phenylcyclopropyl)methanone

(2-chlorophenyl)-(1-phenylcyclopropyl)methanone (PubChem CID 63080543) has the molecular formula C16H13ClO and a molecular weight of 256.73 g/mol. Its IUPAC name is (2-chlorophenyl)-(1-phenylcyclopropyl)methanone.

Molecular Properties

Compound Name(2-chlorophenyl)-(1-phenylcyclopropyl)methanone
PubChem CID63080543
Molecular FormulaC16H13ClO
Molecular Weight256.73 g/mol
Exact Mass256.07
IUPAC Name(2-chlorophenyl)-(1-phenylcyclopropyl)methanone
SMILESO=C(c1ccccc1Cl)C1(c2ccccc2)CC1
InChIInChI=1S/C16H13ClO/c17-14-9-5-4-8-13(14)15(18)16(10-11-16)12-6-2-1-3-7-12/h1-9H,10-11H2
InChIKeyRVHMYMBMFNFCEA-UHFFFAOYSA-N
XLogP4.25
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.73
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2,5-dichlorothiophen-3-yl)-(1-phenylcyclopropyl)methanone
CID 55129258
2-(2-chlorophenyl)-1-(1-phenylcyclopropyl)ethanone
CID 62881925
(1-aminocyclopropyl)-(2-chlorophenyl)methanone
CID 116576455
(5-chlorothiophen-2-yl)-(1-phenylcyclopropyl)methanone
CID 62879150
(1-phenylcyclopropyl)-quinolin-5-ylmethanone
CID 81197158
(2,3-difluorophenyl)-(1-phenylcyclopentyl)methanone
CID 63990466
(2,5-dimethylfuran-3-yl)-(1-phenylcyclopropyl)methanone
CID 62879168
(2-methoxyphenyl)-(1-phenylcyclopentyl)methanone
CID 63410127
(2-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanone
CID 55181920
(5-chloro-4-methylthiophen-2-yl)-(1-phenylcyclopropyl)methanone
CID 102763056
(2-chlorophenyl)-(1-methylcyclohexyl)methanone
CID 22173260
(1-methylindol-3-yl)-(1-phenylcyclopropyl)methanone
CID 62877077

Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl)-(1-phenylcyclopropyl)methanone?
The IUPAC name of (2-chlorophenyl)-(1-phenylcyclopropyl)methanone (CID 63080543) is (2-chlorophenyl)-(1-phenylcyclopropyl)methanone.
What is the SMILES notation for (2-chlorophenyl)-(1-phenylcyclopropyl)methanone?
The canonical SMILES for (2-chlorophenyl)-(1-phenylcyclopropyl)methanone is O=C(c1ccccc1Cl)C1(c2ccccc2)CC1.
What is the InChIKey of (2-chlorophenyl)-(1-phenylcyclopropyl)methanone?
The InChIKey is RVHMYMBMFNFCEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClO/c17-14-9-5-4-8-13(14)15(18)16(10-11-16)12-6-2-1-3-7-12/h1-9H,10-11H2.
What are the key properties of (2-chlorophenyl)-(1-phenylcyclopropyl)methanone?
(2-chlorophenyl)-(1-phenylcyclopropyl)methanone has a molecular weight of 256.73 g/mol, XLogP of 4.25, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)-(1-phenylcyclopropyl)methanone is sourced from PubChem (CID 63080543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).