1-cyclopropyl-3-(3-cyclopropyloxyphenyl)propan-1-one

C15H18O2 — CID 114522899

IUPAC1-cyclopropyl-3-(3-cyclopropyloxyphenyl)propan-1-one
SMILESO=C(CCc1cccc(OC2CC2)c1)C1CC1
InChIInChI=1S/C15H18O2/c16-15(12-5-6-12)9-4-11-2-1-3-14(10-11)17-13-7-8-13/h1-3,10,12-13H,4-9H2
InChIKeyRWGCFMJMDPBUCC-UHFFFAOYSA-N
MW230.31 g/mol
LogP3.14
Rot. Bonds6

About 1-cyclopropyl-3-(3-cyclopropyloxyphenyl)propan-1-one

1-cyclopropyl-3-(3-cyclopropyloxyphenyl)propan-1-one (PubChem CID 114522899) has the molecular formula C15H18O2 and a molecular weight of 230.31 g/mol. Its IUPAC name is 1-cyclopropyl-3-(3-cyclopropyloxyphenyl)propan-1-one.

Molecular Properties

Compound Name1-cyclopropyl-3-(3-cyclopropyloxyphenyl)propan-1-one
PubChem CID114522899
Molecular FormulaC15H18O2
Molecular Weight230.31 g/mol
Exact Mass230.13
IUPAC Name1-cyclopropyl-3-(3-cyclopropyloxyphenyl)propan-1-one
SMILESO=C(CCc1cccc(OC2CC2)c1)C1CC1
InChIInChI=1S/C15H18O2/c16-15(12-5-6-12)9-4-11-2-1-3-14(10-11)17-13-7-8-13/h1-3,10,12-13H,4-9H2
InChIKeyRWGCFMJMDPBUCC-UHFFFAOYSA-N
XLogP3.14
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-cyclopropyl-3-(3-cyclopropyloxyphenyl)propan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-cyclopropyl-3-[3-(trifluoromethoxy)phenyl]propan-1-one
CID 64503594
1-cyclopropyl-4-(3-methoxyphenyl)butan-1-one
CID 64504307
(3-cyclopropyloxyphenyl)methanol
CID 57336629
4-[3-(3-cyclopentyloxyphenyl)propanoylamino]cyclohexane-1-carboxylic acid
CID 119229659
1-cyclopropyl-3-phenylpropan-1-one
CID 24725607
methyl 3-(3-piperidin-4-yloxyphenyl)propanoate
CID 144899460
2-[3-(3-cyclopentyloxyphenyl)propanoyl-ethylamino]acetic acid
CID 119206123
3-(3-cyclobutyloxyphenyl)propan-1-ol
CID 117294966
1-[2-(aminomethyl)piperidin-1-yl]-3-(3-cyclopentyloxyphenyl)propan-1-one;hydrochloride
CID 119469306
ethyl 2-(3-cyclopropyloxyphenyl)acetate
CID 114522675
4-(3-cyclopropyloxyphenyl)butan-2-amine
CID 114522923
1-(3-cyclopropyloxyphenyl)-4-phenylbutan-1-one
CID 105134475

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(3-cyclopropyloxyphenyl)propan-1-one?
The IUPAC name of 1-cyclopropyl-3-(3-cyclopropyloxyphenyl)propan-1-one (CID 114522899) is 1-cyclopropyl-3-(3-cyclopropyloxyphenyl)propan-1-one.
What is the SMILES notation for 1-cyclopropyl-3-(3-cyclopropyloxyphenyl)propan-1-one?
The canonical SMILES for 1-cyclopropyl-3-(3-cyclopropyloxyphenyl)propan-1-one is O=C(CCc1cccc(OC2CC2)c1)C1CC1.
What is the InChIKey of 1-cyclopropyl-3-(3-cyclopropyloxyphenyl)propan-1-one?
The InChIKey is RWGCFMJMDPBUCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O2/c16-15(12-5-6-12)9-4-11-2-1-3-14(10-11)17-13-7-8-13/h1-3,10,12-13H,4-9H2.
What are the key properties of 1-cyclopropyl-3-(3-cyclopropyloxyphenyl)propan-1-one?
1-cyclopropyl-3-(3-cyclopropyloxyphenyl)propan-1-one has a molecular weight of 230.31 g/mol, XLogP of 3.14, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(3-cyclopropyloxyphenyl)propan-1-one is sourced from PubChem (CID 114522899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).