(2S)-2-methyl-6-(2-methylpropyl)-2,3-dihydropyridine

C10H17N — CID 67991639

IUPAC(2S)-2-methyl-6-(2-methylpropyl)-2,3-dihydropyridine
SMILESCC(C)CC1=N[C@@H](C)CC=C1
InChIInChI=1S/C10H17N/c1-8(2)7-10-6-4-5-9(3)11-10/h4,6,8-9H,5,7H2,1-3H3/t9-/m0/s1
InChIKeyOGRRQRMDAYVOIO-VIFPVBQESA-N
MW151.25 g/mol
LogP2.82
Rot. Bonds2

About (2S)-2-methyl-6-(2-methylpropyl)-2,3-dihydropyridine

(2S)-2-methyl-6-(2-methylpropyl)-2,3-dihydropyridine (PubChem CID 67991639) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is (2S)-2-methyl-6-(2-methylpropyl)-2,3-dihydropyridine.

Molecular Properties

Compound Name(2S)-2-methyl-6-(2-methylpropyl)-2,3-dihydropyridine
PubChem CID67991639
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name(2S)-2-methyl-6-(2-methylpropyl)-2,3-dihydropyridine
SMILESCC(C)CC1=N[C@@H](C)CC=C1
InChIInChI=1S/C10H17N/c1-8(2)7-10-6-4-5-9(3)11-10/h4,6,8-9H,5,7H2,1-3H3/t9-/m0/s1
InChIKeyOGRRQRMDAYVOIO-VIFPVBQESA-N
XLogP2.82
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 ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (2S)-2-methyl-6-(2-methylpropyl)-2,3-dihydropyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2S)-2-methyl-6-(2-methylpropyl)-2,3-dihydropyridine?
The IUPAC name of (2S)-2-methyl-6-(2-methylpropyl)-2,3-dihydropyridine (CID 67991639) is (2S)-2-methyl-6-(2-methylpropyl)-2,3-dihydropyridine.
What is the SMILES notation for (2S)-2-methyl-6-(2-methylpropyl)-2,3-dihydropyridine?
The canonical SMILES for (2S)-2-methyl-6-(2-methylpropyl)-2,3-dihydropyridine is CC(C)CC1=N[C@@H](C)CC=C1.
What is the InChIKey of (2S)-2-methyl-6-(2-methylpropyl)-2,3-dihydropyridine?
The InChIKey is OGRRQRMDAYVOIO-VIFPVBQESA-N. The full InChI is InChI=1S/C10H17N/c1-8(2)7-10-6-4-5-9(3)11-10/h4,6,8-9H,5,7H2,1-3H3/t9-/m0/s1.
What are the key properties of (2S)-2-methyl-6-(2-methylpropyl)-2,3-dihydropyridine?
(2S)-2-methyl-6-(2-methylpropyl)-2,3-dihydropyridine has a molecular weight of 151.25 g/mol, XLogP of 2.82, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methyl-6-(2-methylpropyl)-2,3-dihydropyridine is sourced from PubChem (CID 67991639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).