1,5-dimethyl-N-prop-2-enyl-2,4-dihydropyridin-3-imine

C10H16N2 — CID 56627199

IUPAC1,5-dimethyl-N-prop-2-enyl-2,4-dihydropyridin-3-imine
SMILESC=CC/N=C1\CC(C)=CN(C)C1
InChIInChI=1S/C10H16N2/c1-4-5-11-10-6-9(2)7-12(3)8-10/h4,7H,1,5-6,8H2,2-3H3/b11-10+
InChIKeyPACAGUOGKAGMOT-ZHACJKMWSA-N
MW164.25 g/mol
LogP1.85
Rot. Bonds2

About 1,5-dimethyl-N-prop-2-enyl-2,4-dihydropyridin-3-imine

1,5-dimethyl-N-prop-2-enyl-2,4-dihydropyridin-3-imine (PubChem CID 56627199) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 1,5-dimethyl-N-prop-2-enyl-2,4-dihydropyridin-3-imine.

Molecular Properties

Compound Name1,5-dimethyl-N-prop-2-enyl-2,4-dihydropyridin-3-imine
PubChem CID56627199
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name1,5-dimethyl-N-prop-2-enyl-2,4-dihydropyridin-3-imine
SMILESC=CC/N=C1\CC(C)=CN(C)C1
InChIInChI=1S/C10H16N2/c1-4-5-11-10-6-9(2)7-12(3)8-10/h4,7H,1,5-6,8H2,2-3H3/b11-10+
InChIKeyPACAGUOGKAGMOT-ZHACJKMWSA-N
XLogP1.85
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-1,5-dimethyl-2,4-dihydropyridin-3-imine
CID 56613844
1,5-dimethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine
CID 56614183
1,5-diethyl-N-methyl-2,4-dihydropyridin-3-imine
CID 56617025
2-[(1,5-dimethyl-2,4-dihydropyridin-3-ylidene)amino]-N,N-dimethylethanamine
CID 56621105
1,5-dimethyl-N-(2-methylpropyl)-2,4-dihydropyridin-3-imine
CID 56636914
N,1,5-trimethyl-2,4-dihydropyridin-3-imine
CID 56637640
1,5-diethyl-2-methyl-N-propan-2-yl-2,4-dihydropyridin-3-imine
CID 57014228
1,5-diethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine
CID 57052285
1-ethyl-5-methyl-N-propan-2-yl-2,4-dihydropyridin-3-imine
CID 57168100
N-tert-butyl-1,5-dimethyl-2,4-dihydropyridin-3-imine
CID 57231634
1-methyl-N-propan-2-yl-2,4-dihydropyridin-3-imine
CID 57239418
5-ethyl-1-methyl-N-propan-2-yl-2,4-dihydropyridin-3-imine
CID 57276850

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-prop-2-enyl-2,4-dihydropyridin-3-imine?
The IUPAC name of 1,5-dimethyl-N-prop-2-enyl-2,4-dihydropyridin-3-imine (CID 56627199) is 1,5-dimethyl-N-prop-2-enyl-2,4-dihydropyridin-3-imine.
What is the SMILES notation for 1,5-dimethyl-N-prop-2-enyl-2,4-dihydropyridin-3-imine?
The canonical SMILES for 1,5-dimethyl-N-prop-2-enyl-2,4-dihydropyridin-3-imine is C=CC/N=C1\CC(C)=CN(C)C1.
What is the InChIKey of 1,5-dimethyl-N-prop-2-enyl-2,4-dihydropyridin-3-imine?
The InChIKey is PACAGUOGKAGMOT-ZHACJKMWSA-N. The full InChI is InChI=1S/C10H16N2/c1-4-5-11-10-6-9(2)7-12(3)8-10/h4,7H,1,5-6,8H2,2-3H3/b11-10+.
What are the key properties of 1,5-dimethyl-N-prop-2-enyl-2,4-dihydropyridin-3-imine?
1,5-dimethyl-N-prop-2-enyl-2,4-dihydropyridin-3-imine has a molecular weight of 164.25 g/mol, XLogP of 1.85, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-N-prop-2-enyl-2,4-dihydropyridin-3-imine is sourced from PubChem (CID 56627199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).