1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-(3-ethoxycyclobutyl)-N-methylethanamine

C17H26N2O — CID 103169105

IUPAC1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-(3-ethoxycyclobutyl)-N-methylethanamine
SMILESCCOC1CC(CC(NC)C2CCc3cccnc32)C1
InChIInChI=1S/C17H26N2O/c1-3-20-14-9-12(10-14)11-16(18-2)15-7-6-13-5-4-8-19-17(13)15/h4-5,8,12,14-16,18H,3,6-7,9-11H2,1-2H3
InChIKeyWOWVTUMDVHDJRH-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.90
Rot. Bonds6

About 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-(3-ethoxycyclobutyl)-N-methylethanamine

1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-(3-ethoxycyclobutyl)-N-methylethanamine (PubChem CID 103169105) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-(3-ethoxycyclobutyl)-N-methylethanamine.

Molecular Properties

Compound Name1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-(3-ethoxycyclobutyl)-N-methylethanamine
PubChem CID103169105
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-(3-ethoxycyclobutyl)-N-methylethanamine
SMILESCCOC1CC(CC(NC)C2CCc3cccnc32)C1
InChIInChI=1S/C17H26N2O/c1-3-20-14-9-12(10-14)11-16(18-2)15-7-6-13-5-4-8-19-17(13)15/h4-5,8,12,14-16,18H,3,6-7,9-11H2,1-2H3
InChIKeyWOWVTUMDVHDJRH-UHFFFAOYSA-N
XLogP2.90
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-(3-ethoxycyclobutyl)-N-methylethanamine 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

1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-methyl-2-phenylethanamine
CID 79747873
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-ethoxy-N-ethylpropan-1-amine
CID 105166170
N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 79748588
2-(4-chlorophenoxy)-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-methylethanamine
CID 105166131
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-methyl-3-phenylpropan-1-amine
CID 79748593
2-(4-chlorophenyl)-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-methylethanamine
CID 79748582
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-ethyl-2-[(2-methylpropan-2-yl)oxy]ethanamine
CID 105166002
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-(1,1-dioxothiolan-3-yl)-N-ethylethanamine
CID 105166112
N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)but-3-en-1-amine
CID 116660575
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-ethylpentan-1-amine
CID 79747782
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1-(2-ethoxyphenyl)-N-methylmethanamine
CID 115533883
2-(3-chlorophenoxy)-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-methylethanamine
CID 105165989

Frequently Asked Questions

What is the IUPAC name of 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-(3-ethoxycyclobutyl)-N-methylethanamine?
The IUPAC name of 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-(3-ethoxycyclobutyl)-N-methylethanamine (CID 103169105) is 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-(3-ethoxycyclobutyl)-N-methylethanamine.
What is the SMILES notation for 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-(3-ethoxycyclobutyl)-N-methylethanamine?
The canonical SMILES for 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-(3-ethoxycyclobutyl)-N-methylethanamine is CCOC1CC(CC(NC)C2CCc3cccnc32)C1.
What is the InChIKey of 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-(3-ethoxycyclobutyl)-N-methylethanamine?
The InChIKey is WOWVTUMDVHDJRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-3-20-14-9-12(10-14)11-16(18-2)15-7-6-13-5-4-8-19-17(13)15/h4-5,8,12,14-16,18H,3,6-7,9-11H2,1-2H3.
What are the key properties of 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-(3-ethoxycyclobutyl)-N-methylethanamine?
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-(3-ethoxycyclobutyl)-N-methylethanamine has a molecular weight of 274.41 g/mol, XLogP of 2.90, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-(3-ethoxycyclobutyl)-N-methylethanamine is sourced from PubChem (CID 103169105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).