1-ethyl-N-methyl-5-propan-2-ylpyridin-2-imine

C11H18N2 — CID 170109273

IUPAC1-ethyl-N-methyl-5-propan-2-ylpyridin-2-imine
SMILESCCn1cc(C(C)C)cc/c1=N\C
InChIInChI=1S/C11H18N2/c1-5-13-8-10(9(2)3)6-7-11(13)12-4/h6-9H,5H2,1-4H3/b12-11+
InChIKeyQFDJNGFBQBMEBP-VAWYXSNFSA-N
MW178.28 g/mol
LogP2.16
Rot. Bonds2

About 1-ethyl-N-methyl-5-propan-2-ylpyridin-2-imine

1-ethyl-N-methyl-5-propan-2-ylpyridin-2-imine (PubChem CID 170109273) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is 1-ethyl-N-methyl-5-propan-2-ylpyridin-2-imine.

Molecular Properties

Compound Name1-ethyl-N-methyl-5-propan-2-ylpyridin-2-imine
PubChem CID170109273
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Name1-ethyl-N-methyl-5-propan-2-ylpyridin-2-imine
SMILESCCn1cc(C(C)C)cc/c1=N\C
InChIInChI=1S/C11H18N2/c1-5-13-8-10(9(2)3)6-7-11(13)12-4/h6-9H,5H2,1-4H3/b12-11+
InChIKeyQFDJNGFBQBMEBP-VAWYXSNFSA-N
XLogP2.16
TPSA17.29 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-methyl-5-propan-2-ylpyridin-2-imine?
The IUPAC name of 1-ethyl-N-methyl-5-propan-2-ylpyridin-2-imine (CID 170109273) is 1-ethyl-N-methyl-5-propan-2-ylpyridin-2-imine.
What is the SMILES notation for 1-ethyl-N-methyl-5-propan-2-ylpyridin-2-imine?
The canonical SMILES for 1-ethyl-N-methyl-5-propan-2-ylpyridin-2-imine is CCn1cc(C(C)C)cc/c1=N\C.
What is the InChIKey of 1-ethyl-N-methyl-5-propan-2-ylpyridin-2-imine?
The InChIKey is QFDJNGFBQBMEBP-VAWYXSNFSA-N. The full InChI is InChI=1S/C11H18N2/c1-5-13-8-10(9(2)3)6-7-11(13)12-4/h6-9H,5H2,1-4H3/b12-11+.
What are the key properties of 1-ethyl-N-methyl-5-propan-2-ylpyridin-2-imine?
1-ethyl-N-methyl-5-propan-2-ylpyridin-2-imine has a molecular weight of 178.28 g/mol, XLogP of 2.16, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-methyl-5-propan-2-ylpyridin-2-imine is sourced from PubChem (CID 170109273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).