N-ethenyl-N-(2-methylprop-1-enyl)aniline

C12H15N — CID 144789627

IUPACN-ethenyl-N-(2-methylprop-1-enyl)aniline
SMILESC=CN(C=C(C)C)c1ccccc1
InChIInChI=1S/C12H15N/c1-4-13(10-11(2)3)12-8-6-5-7-9-12/h4-10H,1H2,2-3H3
InChIKeyUPFAPMBVPSRXOW-UHFFFAOYSA-N
MW173.26 g/mol
LogP3.56
Rot. Bonds3

About N-ethenyl-N-(2-methylprop-1-enyl)aniline

N-ethenyl-N-(2-methylprop-1-enyl)aniline (PubChem CID 144789627) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is N-ethenyl-N-(2-methylprop-1-enyl)aniline.

Molecular Properties

Compound NameN-ethenyl-N-(2-methylprop-1-enyl)aniline
PubChem CID144789627
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC NameN-ethenyl-N-(2-methylprop-1-enyl)aniline
SMILESC=CN(C=C(C)C)c1ccccc1
InChIInChI=1S/C12H15N/c1-4-13(10-11(2)3)12-8-6-5-7-9-12/h4-10H,1H2,2-3H3
InChIKeyUPFAPMBVPSRXOW-UHFFFAOYSA-N
XLogP3.56
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(E)-1-N-ethenyl-1-N-(2-methylphenyl)prop-1-ene-1,2-diamine
CID 166807260
N-ethenyl-N-propylaniline;methanol;titanium
CID 142734850
N-phenyl-N-prop-1-en-2-yloxyaniline
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CID 135083375
CID 135083375
(Z)-1-(N-aminoanilino)prop-1-en-2-amine;ethane
CID 156860213
N-benzyl-N'-ethenyl-N'-(2-methylprop-1-enyl)ethane-1,2-diamine
CID 89343880
N-methanethioyl-N-phenylmethanethioamide
CID 57484015
N-[(E)-but-2-en-2-yl]-N-prop-2-enylaniline
CID 142821122
N-[(2E,4Z)-hepta-2,4,6-trien-2-yl]-N-iodoaniline
CID 170206355
1-[(2Z)-4-methylpenta-2,4-dien-2-yl]-1-phenylhydrazine
CID 163586551
2-methyl-3-(N-methylanilino)prop-2-enal
CID 174849182
N-(2-methylprop-1-enyl)-4-(2-phenylprop-1-enyl)-N-[4-(2-phenylprop-1-enyl)phenyl]aniline
CID 74063844

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-N-(2-methylprop-1-enyl)aniline?
The IUPAC name of N-ethenyl-N-(2-methylprop-1-enyl)aniline (CID 144789627) is N-ethenyl-N-(2-methylprop-1-enyl)aniline.
What is the SMILES notation for N-ethenyl-N-(2-methylprop-1-enyl)aniline?
The canonical SMILES for N-ethenyl-N-(2-methylprop-1-enyl)aniline is C=CN(C=C(C)C)c1ccccc1.
What is the InChIKey of N-ethenyl-N-(2-methylprop-1-enyl)aniline?
The InChIKey is UPFAPMBVPSRXOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N/c1-4-13(10-11(2)3)12-8-6-5-7-9-12/h4-10H,1H2,2-3H3.
What are the key properties of N-ethenyl-N-(2-methylprop-1-enyl)aniline?
N-ethenyl-N-(2-methylprop-1-enyl)aniline has a molecular weight of 173.26 g/mol, XLogP of 3.56, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N-(2-methylprop-1-enyl)aniline is sourced from PubChem (CID 144789627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).