4-ethyl-2,3-dimethyl-2,3-dihydropyridine

C9H15N — CID 90724082

IUPAC4-ethyl-2,3-dimethyl-2,3-dihydropyridine
SMILESCCC1=CC=NC(C)C1C
InChIInChI=1S/C9H15N/c1-4-9-5-6-10-8(3)7(9)2/h5-8H,4H2,1-3H3
InChIKeyMDNGCMPTCVZMIA-UHFFFAOYSA-N
MW137.23 g/mol
LogP2.43
Rot. Bonds1

About 4-ethyl-2,3-dimethyl-2,3-dihydropyridine

4-ethyl-2,3-dimethyl-2,3-dihydropyridine (PubChem CID 90724082) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is 4-ethyl-2,3-dimethyl-2,3-dihydropyridine.

Molecular Properties

Compound Name4-ethyl-2,3-dimethyl-2,3-dihydropyridine
PubChem CID90724082
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC Name4-ethyl-2,3-dimethyl-2,3-dihydropyridine
SMILESCCC1=CC=NC(C)C1C
InChIInChI=1S/C9H15N/c1-4-9-5-6-10-8(3)7(9)2/h5-8H,4H2,1-3H3
InChIKeyMDNGCMPTCVZMIA-UHFFFAOYSA-N
XLogP2.43
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.23
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,3-Diethyl-2,3-dihydropyridine
CID 53814937
2-fluoro-2-methyl-4-propan-2-yl-3H-pyridine
CID 135127173
4-Methyl-2-propan-2-yl-3-(trifluoromethyl)-2,3-dihydropyridine
CID 172628097
(3S)-N-cyclohexyl-3,7-dimethyloct-6-en-1-imine
CID 13509326
But-2-enylidene-[1-methyl-1-(4-methyl-cyclohex-3-enyl)-ethyl]-amine
CID 5370279
2-Butyl-3,5-dipropyl-2,3-dihydropyridine
CID 85526511
2-Ethyl-3,5-dimethyl-2,3-dihydropyridine
CID 12478339
N-cyclohexyl-1-(4,6-dimethylcyclohex-3-en-1-yl)methanimine
CID 23391680
5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridine
CID 49760373
2,4-Dimethyl-2,3-dihydropyridine
CID 53803640
2,3,4-Trimethyl-2,3-dihydropyridine
CID 53836102
2,6,9,9a-tetrahydro-1H-3-benzazepine
CID 54031920

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2,3-dimethyl-2,3-dihydropyridine?
The IUPAC name of 4-ethyl-2,3-dimethyl-2,3-dihydropyridine (CID 90724082) is 4-ethyl-2,3-dimethyl-2,3-dihydropyridine.
What is the SMILES notation for 4-ethyl-2,3-dimethyl-2,3-dihydropyridine?
The canonical SMILES for 4-ethyl-2,3-dimethyl-2,3-dihydropyridine is CCC1=CC=NC(C)C1C.
What is the InChIKey of 4-ethyl-2,3-dimethyl-2,3-dihydropyridine?
The InChIKey is MDNGCMPTCVZMIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N/c1-4-9-5-6-10-8(3)7(9)2/h5-8H,4H2,1-3H3.
What are the key properties of 4-ethyl-2,3-dimethyl-2,3-dihydropyridine?
4-ethyl-2,3-dimethyl-2,3-dihydropyridine has a molecular weight of 137.23 g/mol, XLogP of 2.43, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2,3-dimethyl-2,3-dihydropyridine is sourced from PubChem (CID 90724082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).