3-methyl-1-propan-2-ylpyridin-2-imine

C9H14N2 — CID 146488061

IUPAC3-methyl-1-propan-2-ylpyridin-2-imine
SMILES[H]/N=c1\c(C)cccn1C(C)C
InChIInChI=1S/C9H14N2/c1-7(2)11-6-4-5-8(3)9(11)10/h4-7,10H,1-3H3/b10-9+
InChIKeyCMDHHCHZWFGTDQ-MDZDMXLPSA-N
MW150.22 g/mol
LogP1.86
Rot. Bonds1

About 3-methyl-1-propan-2-ylpyridin-2-imine

3-methyl-1-propan-2-ylpyridin-2-imine (PubChem CID 146488061) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 3-methyl-1-propan-2-ylpyridin-2-imine.

Molecular Properties

Compound Name3-methyl-1-propan-2-ylpyridin-2-imine
PubChem CID146488061
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name3-methyl-1-propan-2-ylpyridin-2-imine
SMILES[H]/N=c1\c(C)cccn1C(C)C
InChIInChI=1S/C9H14N2/c1-7(2)11-6-4-5-8(3)9(11)10/h4-7,10H,1-3H3/b10-9+
InChIKeyCMDHHCHZWFGTDQ-MDZDMXLPSA-N
XLogP1.86
TPSA28.78 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-propan-2-ylpyridin-2-imine?
The IUPAC name of 3-methyl-1-propan-2-ylpyridin-2-imine (CID 146488061) is 3-methyl-1-propan-2-ylpyridin-2-imine.
What is the SMILES notation for 3-methyl-1-propan-2-ylpyridin-2-imine?
The canonical SMILES for 3-methyl-1-propan-2-ylpyridin-2-imine is [H]/N=c1\c(C)cccn1C(C)C.
What is the InChIKey of 3-methyl-1-propan-2-ylpyridin-2-imine?
The InChIKey is CMDHHCHZWFGTDQ-MDZDMXLPSA-N. The full InChI is InChI=1S/C9H14N2/c1-7(2)11-6-4-5-8(3)9(11)10/h4-7,10H,1-3H3/b10-9+.
What are the key properties of 3-methyl-1-propan-2-ylpyridin-2-imine?
3-methyl-1-propan-2-ylpyridin-2-imine has a molecular weight of 150.22 g/mol, XLogP of 1.86, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-propan-2-ylpyridin-2-imine is sourced from PubChem (CID 146488061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).