1,5-dimethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine

C10H18N2 — CID 56614183

IUPAC1,5-dimethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine
SMILESCC1=CN(C)C/C(=N/C(C)C)C1
InChIInChI=1S/C10H18N2/c1-8(2)11-10-5-9(3)6-12(4)7-10/h6,8H,5,7H2,1-4H3/b11-10+
InChIKeyHOASDTSYYQULSB-ZHACJKMWSA-N
MW166.27 g/mol
LogP2.08
Rot. Bonds1

About 1,5-dimethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine

1,5-dimethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine (PubChem CID 56614183) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 1,5-dimethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine.

Molecular Properties

Compound Name1,5-dimethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine
PubChem CID56614183
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name1,5-dimethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine
SMILESCC1=CN(C)C/C(=N/C(C)C)C1
InChIInChI=1S/C10H18N2/c1-8(2)11-10-5-9(3)6-12(4)7-10/h6,8H,5,7H2,1-4H3/b11-10+
InChIKeyHOASDTSYYQULSB-ZHACJKMWSA-N
XLogP2.08
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 52.08
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

2,3,4-Trimethyl-6-propylpyrazine
CID 123522565
2-(Dimethylaminomethylene)cyclohexanone butylimine
CID 129778991
(1,5-Dimethyl-2,4-dihydropyridin-3-ylidene)hydrazine
CID 56612588
N-ethyl-1,5-dimethyl-2,4-dihydropyridin-3-imine
CID 56613844
5-Methyl-1-(2-methylpropyl)-2,4-dihydropyridin-3-imine
CID 56616930
1,5-diethyl-N-methyl-2,4-dihydropyridin-3-imine
CID 56617025
1,5-Dimethyl-2,4-dihydropyridin-3-imine
CID 56618651
2-[(1,5-dimethyl-2,4-dihydropyridin-3-ylidene)amino]-N,N-dimethylethanamine
CID 56621105
2-Butyl-1,5-dimethyl-2,4-dihydropyridin-3-imine
CID 56626073
1,5-dimethyl-N-prop-2-enyl-2,4-dihydropyridin-3-imine
CID 56627199
N,N-diethyl-3-(3-imino-1,5-dimethyl-2,4-dihydropyridin-2-yl)propan-1-amine
CID 56633612
1,5-Diethyl-2,4-dihydropyridin-3-imine
CID 56635574

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine?
The IUPAC name of 1,5-dimethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine (CID 56614183) is 1,5-dimethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine.
What is the SMILES notation for 1,5-dimethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine?
The canonical SMILES for 1,5-dimethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine is CC1=CN(C)C/C(=N/C(C)C)C1.
What is the InChIKey of 1,5-dimethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine?
The InChIKey is HOASDTSYYQULSB-ZHACJKMWSA-N. The full InChI is InChI=1S/C10H18N2/c1-8(2)11-10-5-9(3)6-12(4)7-10/h6,8H,5,7H2,1-4H3/b11-10+.
What are the key properties of 1,5-dimethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine?
1,5-dimethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine has a molecular weight of 166.27 g/mol, XLogP of 2.08, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine is sourced from PubChem (CID 56614183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).