2-ethyl-3-propan-2-yl-2,3-dihydropyridine

C10H17N — CID 129093497

IUPAC2-ethyl-3-propan-2-yl-2,3-dihydropyridine
SMILESCCC1N=CC=CC1C(C)C
InChIInChI=1S/C10H17N/c1-4-10-9(8(2)3)6-5-7-11-10/h5-10H,4H2,1-3H3
InChIKeyGROYZHVOEGYMKC-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.68
Rot. Bonds2

About 2-ethyl-3-propan-2-yl-2,3-dihydropyridine

2-ethyl-3-propan-2-yl-2,3-dihydropyridine (PubChem CID 129093497) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 2-ethyl-3-propan-2-yl-2,3-dihydropyridine.

Molecular Properties

Compound Name2-ethyl-3-propan-2-yl-2,3-dihydropyridine
PubChem CID129093497
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name2-ethyl-3-propan-2-yl-2,3-dihydropyridine
SMILESCCC1N=CC=CC1C(C)C
InChIInChI=1S/C10H17N/c1-4-10-9(8(2)3)6-5-7-11-10/h5-10H,4H2,1-3H3
InChIKeyGROYZHVOEGYMKC-UHFFFAOYSA-N
XLogP2.68
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3-propan-2-yl-2,3-dihydropyridine?
The IUPAC name of 2-ethyl-3-propan-2-yl-2,3-dihydropyridine (CID 129093497) is 2-ethyl-3-propan-2-yl-2,3-dihydropyridine.
What is the SMILES notation for 2-ethyl-3-propan-2-yl-2,3-dihydropyridine?
The canonical SMILES for 2-ethyl-3-propan-2-yl-2,3-dihydropyridine is CCC1N=CC=CC1C(C)C.
What is the InChIKey of 2-ethyl-3-propan-2-yl-2,3-dihydropyridine?
The InChIKey is GROYZHVOEGYMKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-4-10-9(8(2)3)6-5-7-11-10/h5-10H,4H2,1-3H3.
What are the key properties of 2-ethyl-3-propan-2-yl-2,3-dihydropyridine?
2-ethyl-3-propan-2-yl-2,3-dihydropyridine has a molecular weight of 151.25 g/mol, XLogP of 2.68, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3-propan-2-yl-2,3-dihydropyridine is sourced from PubChem (CID 129093497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).