4-(2-methylpropylamino)phenol

C10H15NO — CID 15847203

IUPAC4-(2-methylpropylamino)phenol
SMILESCC(C)CNc1ccc(O)cc1
InChIInChI=1S/C10H15NO/c1-8(2)7-11-9-3-5-10(12)6-4-9/h3-6,8,11-12H,7H2,1-2H3
InChIKeyPAGULGKYMQWKBN-UHFFFAOYSA-N
MW165.24 g/mol
LogP2.46
Rot. Bonds3

About 4-(2-methylpropylamino)phenol

4-(2-methylpropylamino)phenol (PubChem CID 15847203) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 4-(2-methylpropylamino)phenol.

Molecular Properties

Compound Name4-(2-methylpropylamino)phenol
PubChem CID15847203
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name4-(2-methylpropylamino)phenol
SMILESCC(C)CNc1ccc(O)cc1
InChIInChI=1S/C10H15NO/c1-8(2)7-11-9-3-5-10(12)6-4-9/h3-6,8,11-12H,7H2,1-2H3
InChIKeyPAGULGKYMQWKBN-UHFFFAOYSA-N
XLogP2.46
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

4-(aminomethyl)-N-(2-methylpropyl)aniline
CID 83962134
methyl 4-(2-methylpropylamino)benzoate
CID 12045610
4-[(2-methylpropan-2-yl)oxymethyl]-N-(2-methylpropyl)aniline
CID 146626149
2-chloro-4-(2-methylpropylamino)phenol
CID 107678389
1-(4-hydroxyphenyl)-3-(2-methylpropyl)urea
CID 22947333
4-[[2-(aminomethyl)-3,3,3-trifluoropropyl]amino]phenol
CID 84726902
4-(2-methylpropoxy)-N-(2-methylpropyl)aniline
CID 83946363
1-N,3-N-bis(2-methylpropyl)benzene-1,3-diamine
CID 86210277
4-ethylsulfonyl-N-(2-methylpropyl)aniline
CID 43453340
4-(2-hydroxynonadecylamino)phenol
CID 162495059
N-(2-methylpropyl)-4-phenylmethoxyaniline
CID 57172587
N,N-diethyl-4-(2-methylpropylamino)benzamide
CID 102002843

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpropylamino)phenol?
The IUPAC name of 4-(2-methylpropylamino)phenol (CID 15847203) is 4-(2-methylpropylamino)phenol.
What is the SMILES notation for 4-(2-methylpropylamino)phenol?
The canonical SMILES for 4-(2-methylpropylamino)phenol is CC(C)CNc1ccc(O)cc1.
What is the InChIKey of 4-(2-methylpropylamino)phenol?
The InChIKey is PAGULGKYMQWKBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-8(2)7-11-9-3-5-10(12)6-4-9/h3-6,8,11-12H,7H2,1-2H3.
What are the key properties of 4-(2-methylpropylamino)phenol?
4-(2-methylpropylamino)phenol has a molecular weight of 165.24 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpropylamino)phenol is sourced from PubChem (CID 15847203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).