1-methyl-N-propan-2-yl-2,4-dihydropyridin-3-imine

C9H16N2 — CID 57239418

IUPAC1-methyl-N-propan-2-yl-2,4-dihydropyridin-3-imine
SMILESCC(C)/N=C1\CC=CN(C)C1
InChIInChI=1S/C9H16N2/c1-8(2)10-9-5-4-6-11(3)7-9/h4,6,8H,5,7H2,1-3H3/b10-9+
InChIKeyXGJZZNYMRNNECY-MDZDMXLPSA-N
MW152.24 g/mol
LogP1.68
Rot. Bonds1

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

1-methyl-N-propan-2-yl-2,4-dihydropyridin-3-imine (PubChem CID 57239418) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is 1-methyl-N-propan-2-yl-2,4-dihydropyridin-3-imine.

Molecular Properties

Compound Name1-methyl-N-propan-2-yl-2,4-dihydropyridin-3-imine
PubChem CID57239418
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name1-methyl-N-propan-2-yl-2,4-dihydropyridin-3-imine
SMILESCC(C)/N=C1\CC=CN(C)C1
InChIInChI=1S/C9H16N2/c1-8(2)10-9-5-4-6-11(3)7-9/h4,6,8H,5,7H2,1-3H3/b10-9+
InChIKeyXGJZZNYMRNNECY-MDZDMXLPSA-N
XLogP1.68
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.68
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
1,5-dimethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine
CID 56614183
N,1-dimethyl-2,3-dihydropyridin-4-imine
CID 56625157
1,5-dimethyl-N-prop-2-enyl-2,4-dihydropyridin-3-imine
CID 56627199
1-ethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine
CID 57244631
1-Methyl-2,4-dihydropyridin-3-imine
CID 57245082
2-methyl-1-propan-2-yl-3H-pyrrol-1-ium
CID 58112963
2,3,5-trimethyl-1-prop-1-enyl-2H-pyrazine
CID 86055709
(E)-3-ethenylimino-N,N-dimethylpent-1-en-1-amine
CID 88939004
6-methyl-3,5-dihydro-2H-pyrido[3,4-b]pyrazine
CID 91388078
N,N,2-trimethyl-5-(propan-2-ylideneamino)pent-4-en-1-amine
CID 123324348
6-ethyl-2,3-dimethyl-1-prop-1-en-2-yl-2H-pyrazine
CID 139314202

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-propan-2-yl-2,4-dihydropyridin-3-imine?
The IUPAC name of 1-methyl-N-propan-2-yl-2,4-dihydropyridin-3-imine (CID 57239418) is 1-methyl-N-propan-2-yl-2,4-dihydropyridin-3-imine.
What is the SMILES notation for 1-methyl-N-propan-2-yl-2,4-dihydropyridin-3-imine?
The canonical SMILES for 1-methyl-N-propan-2-yl-2,4-dihydropyridin-3-imine is CC(C)/N=C1\CC=CN(C)C1.
What is the InChIKey of 1-methyl-N-propan-2-yl-2,4-dihydropyridin-3-imine?
The InChIKey is XGJZZNYMRNNECY-MDZDMXLPSA-N. The full InChI is InChI=1S/C9H16N2/c1-8(2)10-9-5-4-6-11(3)7-9/h4,6,8H,5,7H2,1-3H3/b10-9+.
What are the key properties of 1-methyl-N-propan-2-yl-2,4-dihydropyridin-3-imine?
1-methyl-N-propan-2-yl-2,4-dihydropyridin-3-imine has a molecular weight of 152.24 g/mol, XLogP of 1.68, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-propan-2-yl-2,4-dihydropyridin-3-imine is sourced from PubChem (CID 57239418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).