2-(1-aminopropan-2-yl)phenol

C9H13NO — CID 3028046

IUPAC2-(1-aminopropan-2-yl)phenol
SMILESCC(CN)c1ccccc1O
InChIInChI=1S/C9H13NO/c1-7(6-10)8-4-2-3-5-9(8)11/h2-5,7,11H,6,10H2,1H3
InChIKeyMBYOGFLNHGZSSO-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.45
Rot. Bonds2

About 2-(1-aminopropan-2-yl)phenol

2-(1-aminopropan-2-yl)phenol (PubChem CID 3028046) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is 2-(1-aminopropan-2-yl)phenol.

Molecular Properties

Compound Name2-(1-aminopropan-2-yl)phenol
PubChem CID3028046
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name2-(1-aminopropan-2-yl)phenol
SMILESCC(CN)c1ccccc1O
InChIInChI=1S/C9H13NO/c1-7(6-10)8-4-2-3-5-9(8)11/h2-5,7,11H,6,10H2,1H3
InChIKeyMBYOGFLNHGZSSO-UHFFFAOYSA-N
XLogP1.45
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[5-amino-4-(aminomethyl)pentan-2-yl]phenol
CID 83930477
2-(2-propan-2-ylphenyl)propan-1-amine
CID 82599641
2-(1-fluoropropan-2-yl)phenol
CID 19048051
2-(1-aminopropan-2-yl)benzene-1,4-diol
CID 3028773
2-(aminomethyl)-4-(2-hydroxyphenyl)pentanoic acid
CID 69269941
2-[1,4-diamino-3-(2-hydroxyphenyl)butan-2-yl]phenol
CID 170875368
2-butan-2-ylphenol;formaldehyde
CID 66765994
2-(1-aminopropan-2-yl)aniline;dihydrochloride
CID 131857142
2-(1-aminopropan-2-yl)-4-(fluoromethyl)phenol
CID 84659168
2-(6-methylheptan-2-yl)phenol
CID 163037790
2-[2-(1-methoxyethyl)phenyl]propan-1-amine
CID 115113156
2-[2-(2,2-difluoroethylsulfanyl)phenyl]propan-1-amine
CID 84794692

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminopropan-2-yl)phenol?
The IUPAC name of 2-(1-aminopropan-2-yl)phenol (CID 3028046) is 2-(1-aminopropan-2-yl)phenol.
What is the SMILES notation for 2-(1-aminopropan-2-yl)phenol?
The canonical SMILES for 2-(1-aminopropan-2-yl)phenol is CC(CN)c1ccccc1O.
What is the InChIKey of 2-(1-aminopropan-2-yl)phenol?
The InChIKey is MBYOGFLNHGZSSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-7(6-10)8-4-2-3-5-9(8)11/h2-5,7,11H,6,10H2,1H3.
What are the key properties of 2-(1-aminopropan-2-yl)phenol?
2-(1-aminopropan-2-yl)phenol has a molecular weight of 151.21 g/mol, XLogP of 1.45, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminopropan-2-yl)phenol is sourced from PubChem (CID 3028046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).