3-amino-1-(2-cyclopropylphenyl)propan-1-ol

C12H17NO — CID 79982961

IUPAC3-amino-1-(2-cyclopropylphenyl)propan-1-ol
SMILESNCCC(O)c1ccccc1C1CC1
InChIInChI=1S/C12H17NO/c13-8-7-12(14)11-4-2-1-3-10(11)9-5-6-9/h1-4,9,12,14H,5-8,13H2
InChIKeyAUSSJMKDIIQYNH-UHFFFAOYSA-N
MW191.27 g/mol
LogP1.95
Rot. Bonds4

About 3-amino-1-(2-cyclopropylphenyl)propan-1-ol

3-amino-1-(2-cyclopropylphenyl)propan-1-ol (PubChem CID 79982961) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 3-amino-1-(2-cyclopropylphenyl)propan-1-ol.

Molecular Properties

Compound Name3-amino-1-(2-cyclopropylphenyl)propan-1-ol
PubChem CID79982961
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name3-amino-1-(2-cyclopropylphenyl)propan-1-ol
SMILESNCCC(O)c1ccccc1C1CC1
InChIInChI=1S/C12H17NO/c13-8-7-12(14)11-4-2-1-3-10(11)9-5-6-9/h1-4,9,12,14H,5-8,13H2
InChIKeyAUSSJMKDIIQYNH-UHFFFAOYSA-N
XLogP1.95
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 83837309
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1-(2-cyclobutylphenyl)-3-phenylpropan-1-ol
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CID 79982321
1-(2-cyclopropylphenyl)-2-(propan-2-ylamino)ethanol
CID 79982949
3-amino-1-(2-propan-2-ylphenyl)propan-1-ol
CID 82605381
1-(2-cyclopropylphenyl)-3-(1-methylpyrazol-4-yl)propan-1-ol
CID 103006443
3-(2-piperidin-4-ylphenyl)butan-1-amine
CID 117336959
1-(2-cyclopropylphenyl)-2-(2,4,6-trimethylphenyl)ethanol
CID 79970895
1-(2-cyclobutylphenyl)-3-(furan-2-yl)propan-1-ol
CID 105131741
1-(2-cyclopropylphenyl)-2-(3,4-dichlorophenyl)ethanol
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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(2-cyclopropylphenyl)propan-1-ol?
The IUPAC name of 3-amino-1-(2-cyclopropylphenyl)propan-1-ol (CID 79982961) is 3-amino-1-(2-cyclopropylphenyl)propan-1-ol.
What is the SMILES notation for 3-amino-1-(2-cyclopropylphenyl)propan-1-ol?
The canonical SMILES for 3-amino-1-(2-cyclopropylphenyl)propan-1-ol is NCCC(O)c1ccccc1C1CC1.
What is the InChIKey of 3-amino-1-(2-cyclopropylphenyl)propan-1-ol?
The InChIKey is AUSSJMKDIIQYNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c13-8-7-12(14)11-4-2-1-3-10(11)9-5-6-9/h1-4,9,12,14H,5-8,13H2.
What are the key properties of 3-amino-1-(2-cyclopropylphenyl)propan-1-ol?
3-amino-1-(2-cyclopropylphenyl)propan-1-ol has a molecular weight of 191.27 g/mol, XLogP of 1.95, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(2-cyclopropylphenyl)propan-1-ol is sourced from PubChem (CID 79982961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).