2-methoxy-N,N-dimethyl-3-prop-1-en-2-ylaniline

C12H17NO — CID 173049166

IUPAC2-methoxy-N,N-dimethyl-3-prop-1-en-2-ylaniline
SMILESC=C(C)c1cccc(N(C)C)c1OC
InChIInChI=1S/C12H17NO/c1-9(2)10-7-6-8-11(13(3)4)12(10)14-5/h6-8H,1H2,2-5H3
InChIKeyGZEZYZIJMRSCQX-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.79
Rot. Bonds3

About 2-methoxy-N,N-dimethyl-3-prop-1-en-2-ylaniline

2-methoxy-N,N-dimethyl-3-prop-1-en-2-ylaniline (PubChem CID 173049166) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 2-methoxy-N,N-dimethyl-3-prop-1-en-2-ylaniline.

Molecular Properties

Compound Name2-methoxy-N,N-dimethyl-3-prop-1-en-2-ylaniline
PubChem CID173049166
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name2-methoxy-N,N-dimethyl-3-prop-1-en-2-ylaniline
SMILESC=C(C)c1cccc(N(C)C)c1OC
InChIInChI=1S/C12H17NO/c1-9(2)10-7-6-8-11(13(3)4)12(10)14-5/h6-8H,1H2,2-5H3
InChIKeyGZEZYZIJMRSCQX-UHFFFAOYSA-N
XLogP2.79
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(dimethylamino)benzoic acid;2-methylprop-2-enoic acid
CID 146636076
1-[2-[N-methyl-2-(N-methyl-2-prop-1-en-2-ylanilino)anilino]phenyl]ethanone
CID 137482788
CID 67341190
CID 67341190
azane;1-prop-1-en-2-ylnaphthalene
CID 122612227
ditert-butyl-[(E)-3-(2-methoxy-3-prop-1-en-2-ylphenyl)but-2-enyl]phosphane
CID 122398881
2-(3,5-dimethoxyphenoxy)-3-(dimethylamino)phenol
CID 56978790
2-methoxy-N,N-dimethyl-3-(3-methylpentan-3-yl)aniline
CID 142405279
2-(dimethylamino)benzoic acid;ethene
CID 157119009
1-bromo-5-prop-1-en-2-ylnaphthalene
CID 13454953
1,2-bis(prop-1-en-2-yl)benzene;hydrogen peroxide
CID 175029396
lithium 1,2-bis(prop-1-en-2-yl)benzene
CID 22717015
2,3-bis(dimethylamino)benzoic acid
CID 19707647

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N,N-dimethyl-3-prop-1-en-2-ylaniline?
The IUPAC name of 2-methoxy-N,N-dimethyl-3-prop-1-en-2-ylaniline (CID 173049166) is 2-methoxy-N,N-dimethyl-3-prop-1-en-2-ylaniline.
What is the SMILES notation for 2-methoxy-N,N-dimethyl-3-prop-1-en-2-ylaniline?
The canonical SMILES for 2-methoxy-N,N-dimethyl-3-prop-1-en-2-ylaniline is C=C(C)c1cccc(N(C)C)c1OC.
What is the InChIKey of 2-methoxy-N,N-dimethyl-3-prop-1-en-2-ylaniline?
The InChIKey is GZEZYZIJMRSCQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-9(2)10-7-6-8-11(13(3)4)12(10)14-5/h6-8H,1H2,2-5H3.
What are the key properties of 2-methoxy-N,N-dimethyl-3-prop-1-en-2-ylaniline?
2-methoxy-N,N-dimethyl-3-prop-1-en-2-ylaniline has a molecular weight of 191.27 g/mol, XLogP of 2.79, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N,N-dimethyl-3-prop-1-en-2-ylaniline is sourced from PubChem (CID 173049166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).