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

C11H17N — CID 5325740

IUPAC(4R)-2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine
SMILESCC1=CCC2=C1CN(C)C[C@@H]2C
InChIInChI=1S/C11H17N/c1-8-4-5-10-9(2)6-12(3)7-11(8)10/h4,9H,5-7H2,1-3H3/t9-/m0/s1
InChIKeyWHYGCLOSIAFCAR-VIFPVBQESA-N
MW163.26 g/mol
LogP2.21
Rot. Bonds

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

(4R)-2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine (PubChem CID 5325740) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is (4R)-2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine.

Molecular Properties

Compound Name(4R)-2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine
PubChem CID5325740
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC Name(4R)-2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine
SMILESCC1=CCC2=C1CN(C)C[C@@H]2C
InChIInChI=1S/C11H17N/c1-8-4-5-10-9(2)6-12(3)7-11(8)10/h4,9H,5-7H2,1-3H3/t9-/m0/s1
InChIKeyWHYGCLOSIAFCAR-VIFPVBQESA-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

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Frequently Asked Questions

What is the IUPAC name of (4R)-2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine?
The IUPAC name of (4R)-2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine (CID 5325740) is (4R)-2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine.
What is the SMILES notation for (4R)-2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine?
The canonical SMILES for (4R)-2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine is CC1=CCC2=C1CN(C)C[C@@H]2C.
What is the InChIKey of (4R)-2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine?
The InChIKey is WHYGCLOSIAFCAR-VIFPVBQESA-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/t9-/m0/s1.
What are the key properties of (4R)-2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine?
(4R)-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 (4R)-2,4,7-trimethyl-1,3,4,5-tetrahydrocyclopenta[c]pyridine is sourced from PubChem (CID 5325740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).