[2-[(1R)-1-aminopentyl]phenyl]methanol

C12H19NO — CID 55297220

IUPAC[2-[(1R)-1-aminopentyl]phenyl]methanol
SMILESCCCC[C@@H](N)c1ccccc1CO
InChIInChI=1S/C12H19NO/c1-2-3-8-12(13)11-7-5-4-6-10(11)9-14/h4-7,12,14H,2-3,8-9,13H2,1H3/t12-/m1/s1
InChIKeyVQJPGUZSMYKMLX-GFCCVEGCSA-N
MW193.29 g/mol
LogP2.37
Rot. Bonds5

About [2-[(1R)-1-aminopentyl]phenyl]methanol

[2-[(1R)-1-aminopentyl]phenyl]methanol (PubChem CID 55297220) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is [2-[(1R)-1-aminopentyl]phenyl]methanol.

Molecular Properties

Compound Name[2-[(1R)-1-aminopentyl]phenyl]methanol
PubChem CID55297220
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name[2-[(1R)-1-aminopentyl]phenyl]methanol
SMILESCCCC[C@@H](N)c1ccccc1CO
InChIInChI=1S/C12H19NO/c1-2-3-8-12(13)11-7-5-4-6-10(11)9-14/h4-7,12,14H,2-3,8-9,13H2,1H3/t12-/m1/s1
InChIKeyVQJPGUZSMYKMLX-GFCCVEGCSA-N
XLogP2.37
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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(1R)-1-(2-bromophenyl)pentan-1-amine
CID 171198050
[2-[(1R)-1-aminopentyl]-3-pyridinyl]methanol
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1-(2-bromophenyl)hexan-1-amine
CID 62604682
3-amino-3-(2-ethylphenyl)propan-1-ol;hydrochloride
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1-(2-methylphenyl)nonan-1-amine
CID 63412316
3-[(1S)-1-aminopentyl]benzene-1,2-diol;hydrochloride
CID 171220529
3-[(1R)-1-aminohexyl]benzene-1,2-diol
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3-[(1R)-1-aminopentyl]benzene-1,2-diol;hydrochloride
CID 171200994

Frequently Asked Questions

What is the IUPAC name of [2-[(1R)-1-aminopentyl]phenyl]methanol?
The IUPAC name of [2-[(1R)-1-aminopentyl]phenyl]methanol (CID 55297220) is [2-[(1R)-1-aminopentyl]phenyl]methanol.
What is the SMILES notation for [2-[(1R)-1-aminopentyl]phenyl]methanol?
The canonical SMILES for [2-[(1R)-1-aminopentyl]phenyl]methanol is CCCC[C@@H](N)c1ccccc1CO.
What is the InChIKey of [2-[(1R)-1-aminopentyl]phenyl]methanol?
The InChIKey is VQJPGUZSMYKMLX-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H19NO/c1-2-3-8-12(13)11-7-5-4-6-10(11)9-14/h4-7,12,14H,2-3,8-9,13H2,1H3/t12-/m1/s1.
What are the key properties of [2-[(1R)-1-aminopentyl]phenyl]methanol?
[2-[(1R)-1-aminopentyl]phenyl]methanol has a molecular weight of 193.29 g/mol, XLogP of 2.37, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(1R)-1-aminopentyl]phenyl]methanol is sourced from PubChem (CID 55297220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).