4-[3-(methylamino)prop-1-en-2-yl]phenol

C10H13NO — CID 10943494

IUPAC4-[3-(methylamino)prop-1-en-2-yl]phenol
SMILESC=C(CNC)c1ccc(O)cc1
InChIInChI=1S/C10H13NO/c1-8(7-11-2)9-3-5-10(12)6-4-9/h3-6,11-12H,1,7H2,2H3
InChIKeyNCVRMAAMHWVULP-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.62
Rot. Bonds3

About 4-[3-(methylamino)prop-1-en-2-yl]phenol

4-[3-(methylamino)prop-1-en-2-yl]phenol (PubChem CID 10943494) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is 4-[3-(methylamino)prop-1-en-2-yl]phenol.

Molecular Properties

Compound Name4-[3-(methylamino)prop-1-en-2-yl]phenol
PubChem CID10943494
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name4-[3-(methylamino)prop-1-en-2-yl]phenol
SMILESC=C(CNC)c1ccc(O)cc1
InChIInChI=1S/C10H13NO/c1-8(7-11-2)9-3-5-10(12)6-4-9/h3-6,11-12H,1,7H2,2H3
InChIKeyNCVRMAAMHWVULP-UHFFFAOYSA-N
XLogP1.62
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-[3-(methylamino)prop-1-en-2-yl]phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[3-(methylamino)prop-1-en-2-yl]phenol?
The IUPAC name of 4-[3-(methylamino)prop-1-en-2-yl]phenol (CID 10943494) is 4-[3-(methylamino)prop-1-en-2-yl]phenol.
What is the SMILES notation for 4-[3-(methylamino)prop-1-en-2-yl]phenol?
The canonical SMILES for 4-[3-(methylamino)prop-1-en-2-yl]phenol is C=C(CNC)c1ccc(O)cc1.
What is the InChIKey of 4-[3-(methylamino)prop-1-en-2-yl]phenol?
The InChIKey is NCVRMAAMHWVULP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO/c1-8(7-11-2)9-3-5-10(12)6-4-9/h3-6,11-12H,1,7H2,2H3.
What are the key properties of 4-[3-(methylamino)prop-1-en-2-yl]phenol?
4-[3-(methylamino)prop-1-en-2-yl]phenol has a molecular weight of 163.22 g/mol, XLogP of 1.62, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(methylamino)prop-1-en-2-yl]phenol is sourced from PubChem (CID 10943494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).