6-cyclopropyl-4-methyl-2,3-dihydropyridine

C9H13N — CID 123181437

IUPAC6-cyclopropyl-4-methyl-2,3-dihydropyridine
SMILESCC1=CC(C2CC2)=NCC1
InChIInChI=1S/C9H13N/c1-7-4-5-10-9(6-7)8-2-3-8/h6,8H,2-5H2,1H3
InChIKeyKXJAEJBGINKTSI-UHFFFAOYSA-N
MW135.21 g/mol
LogP2.19
Rot. Bonds1

About 6-cyclopropyl-4-methyl-2,3-dihydropyridine

6-cyclopropyl-4-methyl-2,3-dihydropyridine (PubChem CID 123181437) has the molecular formula C9H13N and a molecular weight of 135.21 g/mol. Its IUPAC name is 6-cyclopropyl-4-methyl-2,3-dihydropyridine.

Molecular Properties

Compound Name6-cyclopropyl-4-methyl-2,3-dihydropyridine
PubChem CID123181437
Molecular FormulaC9H13N
Molecular Weight135.21 g/mol
Exact Mass135.10
IUPAC Name6-cyclopropyl-4-methyl-2,3-dihydropyridine
SMILESCC1=CC(C2CC2)=NCC1
InChIInChI=1S/C9H13N/c1-7-4-5-10-9(6-7)8-2-3-8/h6,8H,2-5H2,1H3
InChIKeyKXJAEJBGINKTSI-UHFFFAOYSA-N
XLogP2.19
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.21
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-(Difluoromethyl)-3-ethyl-5-methyl-2,3-dihydropyridine
CID 91353665
3-Cyclopropyl-4-fluoro-6-methyl-2,3-dihydropyridine
CID 163749940
(E)-5-cyclopropyl-2-fluoro-N,2-dimethylhex-4-en-3-imine
CID 166896627
6-[(E)-but-2-en-2-yl]-2,3,4,5-tetrahydropyridine
CID 135038641
(E)-1-cyclopropyl-4,4-difluoro-N,3-dimethylpent-2-en-1-imine
CID 177146204
(E)-1-cyclopropyl-4-fluoro-N,3,4-trimethylpent-2-en-1-imine
CID 177146356
(E)-1-cyclopropyl-4,4,4-trifluoro-N,3-dimethylbut-2-en-1-imine
CID 177146408
2,4,6-Trimethyl-2,3-dihydropyridine
CID 53631314
4-methyl-5-propan-2-yl-2H-pyrrole
CID 58318552
3,5-di(propan-2-yl)-2H-pyrrole
CID 59519975
(6R)-3,4,5-trimethyl-2-azabicyclo[4.1.0]hepta-2,4-diene
CID 68361521
6-Propan-2-yl-2,3-dihydropyridine
CID 70224591

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-4-methyl-2,3-dihydropyridine?
The IUPAC name of 6-cyclopropyl-4-methyl-2,3-dihydropyridine (CID 123181437) is 6-cyclopropyl-4-methyl-2,3-dihydropyridine.
What is the SMILES notation for 6-cyclopropyl-4-methyl-2,3-dihydropyridine?
The canonical SMILES for 6-cyclopropyl-4-methyl-2,3-dihydropyridine is CC1=CC(C2CC2)=NCC1.
What is the InChIKey of 6-cyclopropyl-4-methyl-2,3-dihydropyridine?
The InChIKey is KXJAEJBGINKTSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N/c1-7-4-5-10-9(6-7)8-2-3-8/h6,8H,2-5H2,1H3.
What are the key properties of 6-cyclopropyl-4-methyl-2,3-dihydropyridine?
6-cyclopropyl-4-methyl-2,3-dihydropyridine has a molecular weight of 135.21 g/mol, XLogP of 2.19, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-4-methyl-2,3-dihydropyridine is sourced from PubChem (CID 123181437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).