ethane;1-methyl-2,3-dihydroimidazo[4,5-c]pyridine

C13H27N3 — CID 143245746

IUPACethane;1-methyl-2,3-dihydroimidazo[4,5-c]pyridine
SMILESCC.CC.CC.CN1CNc2cnccc21
InChIInChI=1S/C7H9N3.3C2H6/c1-10-5-9-6-4-8-3-2-7(6)10;3*1-2/h2-4,9H,5H2,1H3;3*1-2H3
InChIKeyJMZAIEFDXLELJF-UHFFFAOYSA-N
MW225.38 g/mol
LogP3.98
Rot. Bonds

About ethane;1-methyl-2,3-dihydroimidazo[4,5-c]pyridine

ethane;1-methyl-2,3-dihydroimidazo[4,5-c]pyridine (PubChem CID 143245746) has the molecular formula C13H27N3 and a molecular weight of 225.38 g/mol. Its IUPAC name is ethane;1-methyl-2,3-dihydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Nameethane;1-methyl-2,3-dihydroimidazo[4,5-c]pyridine
PubChem CID143245746
Molecular FormulaC13H27N3
Molecular Weight225.38 g/mol
Exact Mass225.22
IUPAC Nameethane;1-methyl-2,3-dihydroimidazo[4,5-c]pyridine
SMILESCC.CC.CC.CN1CNc2cnccc21
InChIInChI=1S/C7H9N3.3C2H6/c1-10-5-9-6-4-8-3-2-7(6)10;3*1-2/h2-4,9H,5H2,1H3;3*1-2H3
InChIKeyJMZAIEFDXLELJF-UHFFFAOYSA-N
XLogP3.98
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-2,3-dihydropyrido[4,3-e][1,2,4]thiadiazine 1,1-dioxide
CID 10845683
ethane;3-methyl-1,4-dihydropyrido[3,4-d]pyrimidin-2-one
CID 143776228
3-methyl-6-phenyl-1,2-dihydrobenzimidazole
CID 146504738
1-methyl-3,4-dihydro-2H-1,6-naphthyridine
CID 45079501
1H-1,7-naphthyridine-2,4-dione
CID 125415230
3-methyl-5-propan-2-yl-1,2-dihydrobenzimidazole
CID 162748632
8,21-dimethyl-4,8,12,17,21,25-hexazapentacyclo[21.3.1.110,14.02,7.015,20]octacosa-1(26),2(7),3,5,10(28),11,13,15(20),16,18,23(27),24-dodecaene
CID 58568576
5-iodo-10H-pyrido[4,3-b][1,6]naphthyridine
CID 170081634
2-ethyl-1-methyl-2,4-dihydropyrido[3,4-b]pyrazin-3-one
CID 79295856
3,7-diazabicyclo[4.1.0]hepta-1(6),2,4-triene
CID 139787035
5-methyl-10-[3-[4-(10-methylphenazin-5-yl)-3-pyridinyl]-4-pyridinyl]phenazine
CID 122433704
1,3,3-trimethylpyrrolo[3,2-c]pyridin-2-one
CID 21300254

Frequently Asked Questions

What is the IUPAC name of ethane;1-methyl-2,3-dihydroimidazo[4,5-c]pyridine?
The IUPAC name of ethane;1-methyl-2,3-dihydroimidazo[4,5-c]pyridine (CID 143245746) is ethane;1-methyl-2,3-dihydroimidazo[4,5-c]pyridine.
What is the SMILES notation for ethane;1-methyl-2,3-dihydroimidazo[4,5-c]pyridine?
The canonical SMILES for ethane;1-methyl-2,3-dihydroimidazo[4,5-c]pyridine is CC.CC.CC.CN1CNc2cnccc21.
What is the InChIKey of ethane;1-methyl-2,3-dihydroimidazo[4,5-c]pyridine?
The InChIKey is JMZAIEFDXLELJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3.3C2H6/c1-10-5-9-6-4-8-3-2-7(6)10;3*1-2/h2-4,9H,5H2,1H3;3*1-2H3.
What are the key properties of ethane;1-methyl-2,3-dihydroimidazo[4,5-c]pyridine?
ethane;1-methyl-2,3-dihydroimidazo[4,5-c]pyridine has a molecular weight of 225.38 g/mol, XLogP of 3.98, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-methyl-2,3-dihydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 143245746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).