5-ethenyl-N,N-diethyl-3-methylpyridin-2-amine

C12H18N2 — CID 102544679

IUPAC5-ethenyl-N,N-diethyl-3-methylpyridin-2-amine
SMILESC=Cc1cnc(N(CC)CC)c(C)c1
InChIInChI=1S/C12H18N2/c1-5-11-8-10(4)12(13-9-11)14(6-2)7-3/h5,8-9H,1,6-7H2,2-4H3
InChIKeyJTDIXPXMFAGNRN-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.88
Rot. Bonds4

About 5-ethenyl-N,N-diethyl-3-methylpyridin-2-amine

5-ethenyl-N,N-diethyl-3-methylpyridin-2-amine (PubChem CID 102544679) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 5-ethenyl-N,N-diethyl-3-methylpyridin-2-amine.

Molecular Properties

Compound Name5-ethenyl-N,N-diethyl-3-methylpyridin-2-amine
PubChem CID102544679
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name5-ethenyl-N,N-diethyl-3-methylpyridin-2-amine
SMILESC=Cc1cnc(N(CC)CC)c(C)c1
InChIInChI=1S/C12H18N2/c1-5-11-8-10(4)12(13-9-11)14(6-2)7-3/h5,8-9H,1,6-7H2,2-4H3
InChIKeyJTDIXPXMFAGNRN-UHFFFAOYSA-N
XLogP2.88
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-N,N-diethyl-3-methylpyridin-2-amine?
The IUPAC name of 5-ethenyl-N,N-diethyl-3-methylpyridin-2-amine (CID 102544679) is 5-ethenyl-N,N-diethyl-3-methylpyridin-2-amine.
What is the SMILES notation for 5-ethenyl-N,N-diethyl-3-methylpyridin-2-amine?
The canonical SMILES for 5-ethenyl-N,N-diethyl-3-methylpyridin-2-amine is C=Cc1cnc(N(CC)CC)c(C)c1.
What is the InChIKey of 5-ethenyl-N,N-diethyl-3-methylpyridin-2-amine?
The InChIKey is JTDIXPXMFAGNRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-5-11-8-10(4)12(13-9-11)14(6-2)7-3/h5,8-9H,1,6-7H2,2-4H3.
What are the key properties of 5-ethenyl-N,N-diethyl-3-methylpyridin-2-amine?
5-ethenyl-N,N-diethyl-3-methylpyridin-2-amine has a molecular weight of 190.29 g/mol, XLogP of 2.88, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-N,N-diethyl-3-methylpyridin-2-amine is sourced from PubChem (CID 102544679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).