N-ethyl-N-methyl-2-prop-1-enylaniline

C12H17N — CID 173058466

IUPACN-ethyl-N-methyl-2-prop-1-enylaniline
SMILESCC=Cc1ccccc1N(C)CC
InChIInChI=1S/C12H17N/c1-4-8-11-9-6-7-10-12(11)13(3)5-2/h4,6-10H,5H2,1-3H3
InChIKeyFCGPIIUJUMIJCD-UHFFFAOYSA-N
MW175.27 g/mol
LogP3.18
Rot. Bonds3

About N-ethyl-N-methyl-2-prop-1-enylaniline

N-ethyl-N-methyl-2-prop-1-enylaniline (PubChem CID 173058466) has the molecular formula C12H17N and a molecular weight of 175.27 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-prop-1-enylaniline.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-prop-1-enylaniline
PubChem CID173058466
Molecular FormulaC12H17N
Molecular Weight175.27 g/mol
Exact Mass175.14
IUPAC NameN-ethyl-N-methyl-2-prop-1-enylaniline
SMILESCC=Cc1ccccc1N(C)CC
InChIInChI=1S/C12H17N/c1-4-8-11-9-6-7-10-12(11)13(3)5-2/h4,6-10H,5H2,1-3H3
InChIKeyFCGPIIUJUMIJCD-UHFFFAOYSA-N
XLogP3.18
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.27
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-N-ethyl-2-N-methylbenzene-1,2-diamine;dihydrochloride
CID 155970662
1-ethyl-2-(2-prop-1-enylphenyl)benzene
CID 91183008
2-[(E)-2-(2-chlorophenyl)ethenyl]-1-N-ethyl-1-N-methylbenzene-1,4-diamine
CID 126608123
(E)-3-[2-(diethylamino)phenyl]prop-2-enal
CID 87134709
ethane;1-prop-1-enyl-2-propoxybenzene
CID 91525443
2-[2-(diethylamino)phenyl]-N,N-diethylaniline
CID 158417392
N-ethyl-2-[(Z)-prop-1-enyl]aniline
CID 145027913
1-phenyl-2-[(Z)-prop-1-enyl]benzene
CID 143027726
2-chloro-N-(propan-2-yloxymethyl)-N-(2-prop-1-enylphenyl)butanamide
CID 70585246
ethane;1-ethenyl-2-[(Z)-prop-1-enyl]benzene;methylphosphane;propane
CID 142250050
ethane;1-prop-1-enyl-10-propylcyclodeca-1,3,5,7,9-pentaene
CID 143566637
ethane;1-methyl-2-[(Z)-prop-1-enyl]benzene
CID 145388668

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-prop-1-enylaniline?
The IUPAC name of N-ethyl-N-methyl-2-prop-1-enylaniline (CID 173058466) is N-ethyl-N-methyl-2-prop-1-enylaniline.
What is the SMILES notation for N-ethyl-N-methyl-2-prop-1-enylaniline?
The canonical SMILES for N-ethyl-N-methyl-2-prop-1-enylaniline is CC=Cc1ccccc1N(C)CC.
What is the InChIKey of N-ethyl-N-methyl-2-prop-1-enylaniline?
The InChIKey is FCGPIIUJUMIJCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N/c1-4-8-11-9-6-7-10-12(11)13(3)5-2/h4,6-10H,5H2,1-3H3.
What are the key properties of N-ethyl-N-methyl-2-prop-1-enylaniline?
N-ethyl-N-methyl-2-prop-1-enylaniline has a molecular weight of 175.27 g/mol, XLogP of 3.18, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-prop-1-enylaniline is sourced from PubChem (CID 173058466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).