3-(prop-1-en-2-ylamino)phenol

C9H11NO — CID 143950523

IUPAC3-(prop-1-en-2-ylamino)phenol
SMILESC=C(C)Nc1cccc(O)c1
InChIInChI=1S/C9H11NO/c1-7(2)10-8-4-3-5-9(11)6-8/h3-6,10-11H,1H2,2H3
InChIKeyZOYIHSYFWICOMK-UHFFFAOYSA-N
MW149.19 g/mol
LogP2.34
Rot. Bonds2

About 3-(prop-1-en-2-ylamino)phenol

3-(prop-1-en-2-ylamino)phenol (PubChem CID 143950523) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is 3-(prop-1-en-2-ylamino)phenol.

Molecular Properties

Compound Name3-(prop-1-en-2-ylamino)phenol
PubChem CID143950523
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name3-(prop-1-en-2-ylamino)phenol
SMILESC=C(C)Nc1cccc(O)c1
InChIInChI=1S/C9H11NO/c1-7(2)10-8-4-3-5-9(11)6-8/h3-6,10-11H,1H2,2H3
InChIKeyZOYIHSYFWICOMK-UHFFFAOYSA-N
XLogP2.34
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-N-prop-1-en-2-ylaniline
CID 143032511
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3-[(3-hydroxyphenyl)carbamoyl]but-3-enoic acid
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4-acetamido-N-(3-hydroxyphenyl)benzamide
CID 110463964
N-(3-hydroxyphenyl)-N'-(3-methylphenyl)oxamide
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(2R)-2-hydroxy-N-(3-hydroxyphenyl)propanamide
CID 130735484
N,N'-bis(3-hydroxyphenyl)but-2-enediamide
CID 754651
3-(methylsulfonylmethyl)-N-prop-1-en-2-ylaniline
CID 163663288
3-(ethylamino)phenol
CID 578991
1-amino-3-(3-hydroxyphenyl)urea
CID 23273555
1-(3-hydroxyphenyl)-3-(3-oxobutyl)urea
CID 108894947

Frequently Asked Questions

What is the IUPAC name of 3-(prop-1-en-2-ylamino)phenol?
The IUPAC name of 3-(prop-1-en-2-ylamino)phenol (CID 143950523) is 3-(prop-1-en-2-ylamino)phenol.
What is the SMILES notation for 3-(prop-1-en-2-ylamino)phenol?
The canonical SMILES for 3-(prop-1-en-2-ylamino)phenol is C=C(C)Nc1cccc(O)c1.
What is the InChIKey of 3-(prop-1-en-2-ylamino)phenol?
The InChIKey is ZOYIHSYFWICOMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c1-7(2)10-8-4-3-5-9(11)6-8/h3-6,10-11H,1H2,2H3.
What are the key properties of 3-(prop-1-en-2-ylamino)phenol?
3-(prop-1-en-2-ylamino)phenol has a molecular weight of 149.19 g/mol, XLogP of 2.34, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(prop-1-en-2-ylamino)phenol is sourced from PubChem (CID 143950523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).