3-(2-cyclopropyloxyphenyl)propan-1-amine

C12H17NO — CID 117282623

IUPAC3-(2-cyclopropyloxyphenyl)propan-1-amine
SMILESNCCCc1ccccc1OC1CC1
InChIInChI=1S/C12H17NO/c13-9-3-5-10-4-1-2-6-12(10)14-11-7-8-11/h1-2,4,6,11H,3,5,7-9,13H2
InChIKeyXSOZZCQLEVMFNG-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.12
Rot. Bonds5

About 3-(2-cyclopropyloxyphenyl)propan-1-amine

3-(2-cyclopropyloxyphenyl)propan-1-amine (PubChem CID 117282623) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 3-(2-cyclopropyloxyphenyl)propan-1-amine.

Molecular Properties

Compound Name3-(2-cyclopropyloxyphenyl)propan-1-amine
PubChem CID117282623
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name3-(2-cyclopropyloxyphenyl)propan-1-amine
SMILESNCCCc1ccccc1OC1CC1
InChIInChI=1S/C12H17NO/c13-9-3-5-10-4-1-2-6-12(10)14-11-7-8-11/h1-2,4,6,11H,3,5,7-9,13H2
InChIKeyXSOZZCQLEVMFNG-UHFFFAOYSA-N
XLogP2.12
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-cyclopropyloxy-5-fluorophenyl)propan-1-amine
CID 117298784
3-(5-bromo-2-cyclopropyloxyphenyl)propan-1-amine
CID 117428416
[2-(4-ethylcyclohexyl)oxyphenyl]methanamine
CID 19627431
4-[2-(1-methylpiperidin-3-yl)oxyphenyl]butan-1-amine
CID 117411224
3-(2-cyclopentyloxyphenyl)-N,N-dimethylpropan-1-amine
CID 170866480
2-[2-(1-methylpyrrolidin-3-yl)oxyphenyl]ethanamine
CID 117095351
3-[3-methoxy-2-(thian-4-yloxy)phenyl]propan-1-amine
CID 117451966
3-(2-phenoxyphenyl)propan-1-amine;phosphane
CID 175469418
4-(5-chloro-2-cyclobutyloxyphenyl)butan-1-amine
CID 117387894
4-[2-(difluoromethoxy)phenyl]butan-1-amine
CID 117306539
3-[2-(thiolan-3-yloxy)phenyl]propan-1-ol
CID 117349655
1-(bromomethyl)-2-(4-methylcyclohexyl)oxybenzene
CID 64747332

Frequently Asked Questions

What is the IUPAC name of 3-(2-cyclopropyloxyphenyl)propan-1-amine?
The IUPAC name of 3-(2-cyclopropyloxyphenyl)propan-1-amine (CID 117282623) is 3-(2-cyclopropyloxyphenyl)propan-1-amine.
What is the SMILES notation for 3-(2-cyclopropyloxyphenyl)propan-1-amine?
The canonical SMILES for 3-(2-cyclopropyloxyphenyl)propan-1-amine is NCCCc1ccccc1OC1CC1.
What is the InChIKey of 3-(2-cyclopropyloxyphenyl)propan-1-amine?
The InChIKey is XSOZZCQLEVMFNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c13-9-3-5-10-4-1-2-6-12(10)14-11-7-8-11/h1-2,4,6,11H,3,5,7-9,13H2.
What are the key properties of 3-(2-cyclopropyloxyphenyl)propan-1-amine?
3-(2-cyclopropyloxyphenyl)propan-1-amine has a molecular weight of 191.27 g/mol, XLogP of 2.12, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-cyclopropyloxyphenyl)propan-1-amine is sourced from PubChem (CID 117282623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).