[3-fluoro-4-[3-(methylamino)prop-1-enyl]phenyl]methanol

C11H14FNO — CID 169473492

IUPAC[3-fluoro-4-[3-(methylamino)prop-1-enyl]phenyl]methanol
SMILESCNCC=Cc1ccc(CO)cc1F
InChIInChI=1S/C11H14FNO/c1-13-6-2-3-10-5-4-9(8-14)7-11(10)12/h2-5,7,13-14H,6,8H2,1H3
InChIKeyYUOKZXQHQJMZFB-UHFFFAOYSA-N
MW195.24 g/mol
LogP1.55
Rot. Bonds4

About [3-fluoro-4-[3-(methylamino)prop-1-enyl]phenyl]methanol

[3-fluoro-4-[3-(methylamino)prop-1-enyl]phenyl]methanol (PubChem CID 169473492) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is [3-fluoro-4-[3-(methylamino)prop-1-enyl]phenyl]methanol.

Molecular Properties

Compound Name[3-fluoro-4-[3-(methylamino)prop-1-enyl]phenyl]methanol
PubChem CID169473492
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC Name[3-fluoro-4-[3-(methylamino)prop-1-enyl]phenyl]methanol
SMILESCNCC=Cc1ccc(CO)cc1F
InChIInChI=1S/C11H14FNO/c1-13-6-2-3-10-5-4-9(8-14)7-11(10)12/h2-5,7,13-14H,6,8H2,1H3
InChIKeyYUOKZXQHQJMZFB-UHFFFAOYSA-N
XLogP1.55
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[3-fluoro-4-(3-sulfanylprop-1-enyl)phenyl]methanol
CID 169455042
(E)-3-(4-chloro-2-fluorophenyl)-N-methylprop-2-en-1-amine
CID 114867476
methyl 3-[2-fluoro-4-(hydroxymethyl)phenyl]prop-2-enoate
CID 169478909
benzyl N-[3-[2-fluoro-4-(hydroxymethyl)phenyl]prop-2-enyl]carbamate
CID 169471497
N-[3-[4-(hydroxymethyl)-2-methylphenyl]prop-2-enyl]acetamide
CID 169465372
(3,4-difluorophenyl)methanol
CID 522833
2-[3-fluoro-4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]prop-1-enyl]phenyl]acetic acid
CID 169468012
3-(4-amino-2-fluorophenyl)prop-2-en-1-ol
CID 169453035
[3-(4-chlorobut-1-enyl)-4-fluorophenyl]methanol
CID 170499033
3-(2-chloro-4-fluorophenyl)-N-methylprop-2-en-1-amine
CID 169473168
[3-fluoro-4-[(4-methylphenyl)methyl]phenyl]methanol
CID 91159196
4-fluoro-3-[3-(methylamino)prop-1-enyl]aniline
CID 169473282

Frequently Asked Questions

What is the IUPAC name of [3-fluoro-4-[3-(methylamino)prop-1-enyl]phenyl]methanol?
The IUPAC name of [3-fluoro-4-[3-(methylamino)prop-1-enyl]phenyl]methanol (CID 169473492) is [3-fluoro-4-[3-(methylamino)prop-1-enyl]phenyl]methanol.
What is the SMILES notation for [3-fluoro-4-[3-(methylamino)prop-1-enyl]phenyl]methanol?
The canonical SMILES for [3-fluoro-4-[3-(methylamino)prop-1-enyl]phenyl]methanol is CNCC=Cc1ccc(CO)cc1F.
What is the InChIKey of [3-fluoro-4-[3-(methylamino)prop-1-enyl]phenyl]methanol?
The InChIKey is YUOKZXQHQJMZFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO/c1-13-6-2-3-10-5-4-9(8-14)7-11(10)12/h2-5,7,13-14H,6,8H2,1H3.
What are the key properties of [3-fluoro-4-[3-(methylamino)prop-1-enyl]phenyl]methanol?
[3-fluoro-4-[3-(methylamino)prop-1-enyl]phenyl]methanol has a molecular weight of 195.24 g/mol, XLogP of 1.55, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-fluoro-4-[3-(methylamino)prop-1-enyl]phenyl]methanol is sourced from PubChem (CID 169473492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).