ethane;N-methyl-1-propan-2-ylpyridin-2-imine

C11H20N2 — CID 178051695

IUPACethane;N-methyl-1-propan-2-ylpyridin-2-imine
SMILESC/N=c1\ccccn1C(C)C.CC
InChIInChI=1S/C9H14N2.C2H6/c1-8(2)11-7-5-4-6-9(11)10-3;1-2/h4-8H,1-3H3;1-2H3/b10-9+;
InChIKeyAHQBPFWJEMRLOX-RRABGKBLSA-N
MW180.29 g/mol
LogP2.63
Rot. Bonds1

About ethane;N-methyl-1-propan-2-ylpyridin-2-imine

ethane;N-methyl-1-propan-2-ylpyridin-2-imine (PubChem CID 178051695) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is ethane;N-methyl-1-propan-2-ylpyridin-2-imine.

Molecular Properties

Compound Nameethane;N-methyl-1-propan-2-ylpyridin-2-imine
PubChem CID178051695
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC Nameethane;N-methyl-1-propan-2-ylpyridin-2-imine
SMILESC/N=c1\ccccn1C(C)C.CC
InChIInChI=1S/C9H14N2.C2H6/c1-8(2)11-7-5-4-6-9(11)10-3;1-2/h4-8H,1-3H3;1-2H3/b10-9+;
InChIKeyAHQBPFWJEMRLOX-RRABGKBLSA-N
XLogP2.63
TPSA17.29 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 20094215
4-Methyl-4h-pyrido[1,2-a]pyrimidine
CID 129791993
Pyrido-[1,2-a]-1,3-diazepine
CID 129798958
1-ethenyl-5-fluoro-N-methylpyridin-2-imine
CID 68334595
(2R)-7-fluoro-2-methyl-2,3-dihydroimidazo[1,2-a]pyridine
CID 89703895
(2R)-3-fluoro-2-methyl-2,3-dihydroimidazo[1,2-a]pyridine
CID 89703902
4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine
CID 156652493
(2E)-N-Cyclopropyl-1-methylpyridin-2(1H)-imine
CID 45088176
2-(Azaethylidene)-1-methylhydropyridine
CID 4463569
4-Ethylimidazo[1,2-a]pyridin-4-ium
CID 18001023
2-Methyl-2,3-dihydroimidazo[1,2-a]pyridine
CID 18452952
N,1-di(propan-2-yl)pyridin-2-imine
CID 20601372

Frequently Asked Questions

What is the IUPAC name of ethane;N-methyl-1-propan-2-ylpyridin-2-imine?
The IUPAC name of ethane;N-methyl-1-propan-2-ylpyridin-2-imine (CID 178051695) is ethane;N-methyl-1-propan-2-ylpyridin-2-imine.
What is the SMILES notation for ethane;N-methyl-1-propan-2-ylpyridin-2-imine?
The canonical SMILES for ethane;N-methyl-1-propan-2-ylpyridin-2-imine is C/N=c1\ccccn1C(C)C.CC.
What is the InChIKey of ethane;N-methyl-1-propan-2-ylpyridin-2-imine?
The InChIKey is AHQBPFWJEMRLOX-RRABGKBLSA-N. The full InChI is InChI=1S/C9H14N2.C2H6/c1-8(2)11-7-5-4-6-9(11)10-3;1-2/h4-8H,1-3H3;1-2H3/b10-9+;.
What are the key properties of ethane;N-methyl-1-propan-2-ylpyridin-2-imine?
ethane;N-methyl-1-propan-2-ylpyridin-2-imine has a molecular weight of 180.29 g/mol, XLogP of 2.63, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methyl-1-propan-2-ylpyridin-2-imine is sourced from PubChem (CID 178051695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).