(Z)-N-(3,6-dimethyl-2-pyridinyl)prop-2-en-1-imine

C10H12N2 — CID 142888493

IUPAC(Z)-N-(3,6-dimethyl-2-pyridinyl)prop-2-en-1-imine
SMILESC=C/C=N\c1nc(C)ccc1C
InChIInChI=1S/C10H12N2/c1-4-7-11-10-8(2)5-6-9(3)12-10/h4-7H,1H2,2-3H3/b11-7-
InChIKeyJQZVZFKJPFZKSG-XFFZJAGNSA-N
MW160.22 g/mol
LogP2.59
Rot. Bonds2

About (Z)-N-(3,6-dimethyl-2-pyridinyl)prop-2-en-1-imine

(Z)-N-(3,6-dimethyl-2-pyridinyl)prop-2-en-1-imine (PubChem CID 142888493) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is (Z)-N-(3,6-dimethyl-2-pyridinyl)prop-2-en-1-imine.

Molecular Properties

Compound Name(Z)-N-(3,6-dimethyl-2-pyridinyl)prop-2-en-1-imine
PubChem CID142888493
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Name(Z)-N-(3,6-dimethyl-2-pyridinyl)prop-2-en-1-imine
SMILESC=C/C=N\c1nc(C)ccc1C
InChIInChI=1S/C10H12N2/c1-4-7-11-10-8(2)5-6-9(3)12-10/h4-7H,1H2,2-3H3/b11-7-
InChIKeyJQZVZFKJPFZKSG-XFFZJAGNSA-N
XLogP2.59
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-(6-methyl-3-pyridinyl)prop-2-en-1-imine
CID 143838526
3,6-dimethyl-2-[(4Z)-2-methylhepta-2,4,6-trien-3-yl]pyridine;ethane
CID 145196787
(Z)-N-(5-ethyl-1,2-dimethylimidazol-4-yl)prop-2-en-1-imine
CID 142995435
N'-(3-cyano-6-methyl-2-pyridinyl)-N,N-dimethylmethanimidamide
CID 143498002
ethane;N-[6-methyl-2-(methylideneamino)-3-pyridinyl]methanimine
CID 144624911
2-(difluoromethyl)-3,6-dimethylpyridine
CID 121232017
ethane;(Z)-N-(3-methyl-1H-pyrrol-2-yl)prop-2-en-1-imine;propane
CID 144842549
(2E,3Z)-2-ethylidene-6-methyl-3-prop-2-enylidenepyridine
CID 143069018
2-cyclopropyl-3,6-dimethylpyridine;ethane
CID 177212945
(Z)-N-(3,5-dimethylimidazol-4-yl)prop-2-en-1-imine
CID 142892588
N-(5-ethenyltriazin-4-yl)prop-2-en-1-imine
CID 123742708
N-[3,7-dimethyl-8-(methylideneamino)-10-phenylphenazin-10-ium-2-yl]prop-2-en-1-imine
CID 130467467

Frequently Asked Questions

What is the IUPAC name of (Z)-N-(3,6-dimethyl-2-pyridinyl)prop-2-en-1-imine?
The IUPAC name of (Z)-N-(3,6-dimethyl-2-pyridinyl)prop-2-en-1-imine (CID 142888493) is (Z)-N-(3,6-dimethyl-2-pyridinyl)prop-2-en-1-imine.
What is the SMILES notation for (Z)-N-(3,6-dimethyl-2-pyridinyl)prop-2-en-1-imine?
The canonical SMILES for (Z)-N-(3,6-dimethyl-2-pyridinyl)prop-2-en-1-imine is C=C/C=N\c1nc(C)ccc1C.
What is the InChIKey of (Z)-N-(3,6-dimethyl-2-pyridinyl)prop-2-en-1-imine?
The InChIKey is JQZVZFKJPFZKSG-XFFZJAGNSA-N. The full InChI is InChI=1S/C10H12N2/c1-4-7-11-10-8(2)5-6-9(3)12-10/h4-7H,1H2,2-3H3/b11-7-.
What are the key properties of (Z)-N-(3,6-dimethyl-2-pyridinyl)prop-2-en-1-imine?
(Z)-N-(3,6-dimethyl-2-pyridinyl)prop-2-en-1-imine has a molecular weight of 160.22 g/mol, XLogP of 2.59, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(3,6-dimethyl-2-pyridinyl)prop-2-en-1-imine is sourced from PubChem (CID 142888493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).