[3-(3-methylbut-2-enylidene)-2-propylidene-4-pyridinyl]methanamine

C14H20N2 — CID 90974862

IUPAC[3-(3-methylbut-2-enylidene)-2-propylidene-4-pyridinyl]methanamine
SMILESCCC=c1nccc(CN)c1=CC=C(C)C
InChIInChI=1S/C14H20N2/c1-4-5-14-13(7-6-11(2)3)12(10-15)8-9-16-14/h5-9H,4,10,15H2,1-3H3
InChIKeyFUVWRVRPEYJQKA-UHFFFAOYSA-N
MW216.33 g/mol
LogP1.48
Rot. Bonds3

About [3-(3-methylbut-2-enylidene)-2-propylidene-4-pyridinyl]methanamine

[3-(3-methylbut-2-enylidene)-2-propylidene-4-pyridinyl]methanamine (PubChem CID 90974862) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is [3-(3-methylbut-2-enylidene)-2-propylidene-4-pyridinyl]methanamine.

Molecular Properties

Compound Name[3-(3-methylbut-2-enylidene)-2-propylidene-4-pyridinyl]methanamine
PubChem CID90974862
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name[3-(3-methylbut-2-enylidene)-2-propylidene-4-pyridinyl]methanamine
SMILESCCC=c1nccc(CN)c1=CC=C(C)C
InChIInChI=1S/C14H20N2/c1-4-5-14-13(7-6-11(2)3)12(10-15)8-9-16-14/h5-9H,4,10,15H2,1-3H3
InChIKeyFUVWRVRPEYJQKA-UHFFFAOYSA-N
XLogP1.48
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2E)-2-[(E)-3-fluorobut-2-enylidene]-4-methyl-3-methylidenepyridine
CID 135128526
(2E)-2-[(1Z)-1-(ethylideneamino)buta-1,3-dienyl]-3-(fluoromethyl)hexa-2,5-dienimidoyl fluoride
CID 167120260
N-(6-propylidenecyclohexa-1,3-dien-1-yl)propan-1-imine
CID 53831115
(3Z)-3-(methyliminomethyl)hexa-1,3-dien-2-amine
CID 60123978
N-(6-methylcyclohexa-1,5-dien-1-yl)ethanimine
CID 68266833
6H-1,4-benzodiazepin-7-amine
CID 68513910
1-[(2S)-2,3-dimethyl-3,6-dihydro-2H-azepin-5-yl]ethenamine
CID 69915408
Isobutylidene-2-aminomethylpyridine
CID 70543438
(3-butylidene-2H-pyridin-2-yl)methanamine
CID 70596862
2-(cyclohexa-1,5-dien-1-ylmethylideneamino)-N-methylcyclohexa-1,5-dien-1-amine
CID 70856836
(5Z,6E)-5-ethylidene-6-prop-2-enylidenepyridin-3-amine
CID 87171102
(2E)-N-methyl-2-(3-methylidene-2-pyridinylidene)ethanimine
CID 88271063

Frequently Asked Questions

What is the IUPAC name of [3-(3-methylbut-2-enylidene)-2-propylidene-4-pyridinyl]methanamine?
The IUPAC name of [3-(3-methylbut-2-enylidene)-2-propylidene-4-pyridinyl]methanamine (CID 90974862) is [3-(3-methylbut-2-enylidene)-2-propylidene-4-pyridinyl]methanamine.
What is the SMILES notation for [3-(3-methylbut-2-enylidene)-2-propylidene-4-pyridinyl]methanamine?
The canonical SMILES for [3-(3-methylbut-2-enylidene)-2-propylidene-4-pyridinyl]methanamine is CCC=c1nccc(CN)c1=CC=C(C)C.
What is the InChIKey of [3-(3-methylbut-2-enylidene)-2-propylidene-4-pyridinyl]methanamine?
The InChIKey is FUVWRVRPEYJQKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-4-5-14-13(7-6-11(2)3)12(10-15)8-9-16-14/h5-9H,4,10,15H2,1-3H3.
What are the key properties of [3-(3-methylbut-2-enylidene)-2-propylidene-4-pyridinyl]methanamine?
[3-(3-methylbut-2-enylidene)-2-propylidene-4-pyridinyl]methanamine has a molecular weight of 216.33 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(3-methylbut-2-enylidene)-2-propylidene-4-pyridinyl]methanamine is sourced from PubChem (CID 90974862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).