1-pyridin-3-yl-N,N-bis(pyridin-2-ylmethyl)ethenamine

C19H18N4 — CID 118234431

IUPAC1-pyridin-3-yl-N,N-bis(pyridin-2-ylmethyl)ethenamine
SMILESC=C(c1cccnc1)N(Cc1ccccn1)Cc1ccccn1
InChIInChI=1S/C19H18N4/c1-16(17-7-6-10-20-13-17)23(14-18-8-2-4-11-21-18)15-19-9-3-5-12-22-19/h2-13H,1,14-15H2
InChIKeyDZTKAKQEWILUCP-UHFFFAOYSA-N
MW302.38 g/mol
LogP3.54
Rot. Bonds6

About 1-pyridin-3-yl-N,N-bis(pyridin-2-ylmethyl)ethenamine

1-pyridin-3-yl-N,N-bis(pyridin-2-ylmethyl)ethenamine (PubChem CID 118234431) has the molecular formula C19H18N4 and a molecular weight of 302.38 g/mol. Its IUPAC name is 1-pyridin-3-yl-N,N-bis(pyridin-2-ylmethyl)ethenamine.

Molecular Properties

Compound Name1-pyridin-3-yl-N,N-bis(pyridin-2-ylmethyl)ethenamine
PubChem CID118234431
Molecular FormulaC19H18N4
Molecular Weight302.38 g/mol
Exact Mass302.15
IUPAC Name1-pyridin-3-yl-N,N-bis(pyridin-2-ylmethyl)ethenamine
SMILESC=C(c1cccnc1)N(Cc1ccccn1)Cc1ccccn1
InChIInChI=1S/C19H18N4/c1-16(17-7-6-10-20-13-17)23(14-18-8-2-4-11-21-18)15-19-9-3-5-12-22-19/h2-13H,1,14-15H2
InChIKeyDZTKAKQEWILUCP-UHFFFAOYSA-N
XLogP3.54
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(pyridin-2-ylmethyl)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 102199988
N-prop-2-enyl-2-pyridin-3-yl-N-(pyridin-2-ylmethyl)acetamide
CID 56750676
1-(3-azabicyclo[4.1.0]hepta-2,4-dien-5-yl)-N,N-bis(pyridin-2-ylmethyl)ethenamine
CID 144884140
N-[2-(dimethylamino)ethyl]-2-pyridin-3-yl-N-(pyridin-2-ylmethyl)cyclopropane-1-carboxamide
CID 56783064
copper;1-pyridin-2-yl-N,N-bis(pyridin-2-ylmethyl)methanamine
CID 130339696
3-(4-methylphenyl)-1-(pyridin-2-ylmethyl)-1-(pyridin-3-ylmethyl)thiourea
CID 17370577
2-(2-methylprop-2-enyl)pyridine
CID 12534227
N-methyl-1-(pyridine-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide
CID 71998761
pyridin-3-yl-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone
CID 704367
CID 88902013
CID 88902013
N,N-dibenzylpyridine-3-carbothioamide
CID 125491069
N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)benzamide
CID 61242674

Frequently Asked Questions

What is the IUPAC name of 1-pyridin-3-yl-N,N-bis(pyridin-2-ylmethyl)ethenamine?
The IUPAC name of 1-pyridin-3-yl-N,N-bis(pyridin-2-ylmethyl)ethenamine (CID 118234431) is 1-pyridin-3-yl-N,N-bis(pyridin-2-ylmethyl)ethenamine.
What is the SMILES notation for 1-pyridin-3-yl-N,N-bis(pyridin-2-ylmethyl)ethenamine?
The canonical SMILES for 1-pyridin-3-yl-N,N-bis(pyridin-2-ylmethyl)ethenamine is C=C(c1cccnc1)N(Cc1ccccn1)Cc1ccccn1.
What is the InChIKey of 1-pyridin-3-yl-N,N-bis(pyridin-2-ylmethyl)ethenamine?
The InChIKey is DZTKAKQEWILUCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4/c1-16(17-7-6-10-20-13-17)23(14-18-8-2-4-11-21-18)15-19-9-3-5-12-22-19/h2-13H,1,14-15H2.
What are the key properties of 1-pyridin-3-yl-N,N-bis(pyridin-2-ylmethyl)ethenamine?
1-pyridin-3-yl-N,N-bis(pyridin-2-ylmethyl)ethenamine has a molecular weight of 302.38 g/mol, XLogP of 3.54, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-3-yl-N,N-bis(pyridin-2-ylmethyl)ethenamine is sourced from PubChem (CID 118234431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).