2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine

C11H17N — CID 15599796

IUPAC2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine
SMILESCC1=CCC2=C1CN(C)CC2C
InChIInChI=1S/C11H17N/c1-8-4-5-10-9(2)6-12(3)7-11(8)10/h4,9H,5-7H2,1-3H3
InChIKeyWHYGCLOSIAFCAR-UHFFFAOYSA-N
MW163.26 g/mol
LogP2.21
Rot. Bonds

About 2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine

2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine (PubChem CID 15599796) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is 2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine.

Molecular Properties

Compound Name2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine
PubChem CID15599796
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC Name2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine
SMILESCC1=CCC2=C1CN(C)CC2C
InChIInChI=1S/C11H17N/c1-8-4-5-10-9(2)6-12(3)7-11(8)10/h4,9H,5-7H2,1-3H3
InChIKeyWHYGCLOSIAFCAR-UHFFFAOYSA-N
XLogP2.21
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine with MolForge

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

Launch Full Analysis

Related Compounds

4-Cyclopenta-1,3-dien-1-yl-1-methylpiperidine
CID 12982244
N-ethyl-1-fluoro-N-(2-methylpentyl)cyclohexa-2,4-dien-1-amine
CID 23123337
1-ethyl-3-fluoro-4-propan-2-yl-3,6-dihydro-2H-pyridine
CID 122642786
3-fluoro-1-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridine
CID 145646345
6-Fluoro-2-propan-2-yl-1,3,4,5-tetrahydroisoindole
CID 166553100
2-Ethyl-6-fluoro-1,3,4,5-tetrahydroisoindole
CID 166553254
6-Fluoro-2-methyl-1,3,4,5-tetrahydroisoindole
CID 171833394
4-fluoro-1-methyl-3-propyl-3,6-dihydro-2H-pyridine
CID 178009524
4-fluoro-1-methyl-3-(2-methylpropyl)-3,6-dihydro-2H-pyridine
CID 178009595
1,3-Cyclopentadiene, 5-[3-(dimethylamino)propyl]-
CID 547179
(7Z)-2-methyl-1,3,4,5,6,11a-hexahydro-2-benzazonine
CID 14004187
(7E)-2,8-dimethyl-1,3,4,5,6,11a-hexahydro-2-benzazonine
CID 14004189

Frequently Asked Questions

What is the IUPAC name of 2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine?
The IUPAC name of 2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine (CID 15599796) is 2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine.
What is the SMILES notation for 2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine?
The canonical SMILES for 2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine is CC1=CCC2=C1CN(C)CC2C.
What is the InChIKey of 2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine?
The InChIKey is WHYGCLOSIAFCAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N/c1-8-4-5-10-9(2)6-12(3)7-11(8)10/h4,9H,5-7H2,1-3H3.
What are the key properties of 2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine?
2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine has a molecular weight of 163.26 g/mol, XLogP of 2.21, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine is sourced from PubChem (CID 15599796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).