6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methoxy-4-methylcyclohexyl)methanamine

C17H26N2O — CID 116766235

IUPAC6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methoxy-4-methylcyclohexyl)methanamine
SMILESCOC1(C(N)C2CCc3cccnc32)CCC(C)CC1
InChIInChI=1S/C17H26N2O/c1-12-7-9-17(20-2,10-8-12)16(18)14-6-5-13-4-3-11-19-15(13)14/h3-4,11-12,14,16H,5-10,18H2,1-2H3
InChIKeyUVADHVSPCPIKDE-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.03
Rot. Bonds3

About 6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methoxy-4-methylcyclohexyl)methanamine

6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methoxy-4-methylcyclohexyl)methanamine (PubChem CID 116766235) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methoxy-4-methylcyclohexyl)methanamine.

Molecular Properties

Compound Name6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methoxy-4-methylcyclohexyl)methanamine
PubChem CID116766235
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methoxy-4-methylcyclohexyl)methanamine
SMILESCOC1(C(N)C2CCc3cccnc32)CCC(C)CC1
InChIInChI=1S/C17H26N2O/c1-12-7-9-17(20-2,10-8-12)16(18)14-6-5-13-4-3-11-19-15(13)14/h3-4,11-12,14,16H,5-10,18H2,1-2H3
InChIKeyUVADHVSPCPIKDE-UHFFFAOYSA-N
XLogP3.03
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methylcyclohexyl)methanamine
CID 106830346
[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(4-methoxyoxan-4-yl)methyl]hydrazine
CID 105276619
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-methoxyethanamine
CID 79747968
(1-ethoxycyclohexyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine
CID 116763627
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-ethoxyethanamine
CID 79747927
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(2,2-dimethylcyclopropyl)methanamine
CID 107004734
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(2-methoxyphenyl)methanamine
CID 79745843
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(2,5-dimethoxyphenyl)methanamine
CID 105009947
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butan-1-amine
CID 79748418
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-methylbutan-1-amine
CID 79748029
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(2-methylphenyl)methanamine
CID 79748906
[6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methylcyclopentyl)methyl]hydrazine
CID 105322002

Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methoxy-4-methylcyclohexyl)methanamine?
The IUPAC name of 6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methoxy-4-methylcyclohexyl)methanamine (CID 116766235) is 6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methoxy-4-methylcyclohexyl)methanamine.
What is the SMILES notation for 6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methoxy-4-methylcyclohexyl)methanamine?
The canonical SMILES for 6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methoxy-4-methylcyclohexyl)methanamine is COC1(C(N)C2CCc3cccnc32)CCC(C)CC1.
What is the InChIKey of 6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methoxy-4-methylcyclohexyl)methanamine?
The InChIKey is UVADHVSPCPIKDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-12-7-9-17(20-2,10-8-12)16(18)14-6-5-13-4-3-11-19-15(13)14/h3-4,11-12,14,16H,5-10,18H2,1-2H3.
What are the key properties of 6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methoxy-4-methylcyclohexyl)methanamine?
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methoxy-4-methylcyclohexyl)methanamine has a molecular weight of 274.41 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methoxy-4-methylcyclohexyl)methanamine is sourced from PubChem (CID 116766235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).