3-[[9-(cyclopropylmethylamino)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-6-yl]oxy]propanamide

C20H25N3O3 — CID 155284240

IUPAC3-[[9-(cyclopropylmethylamino)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-6-yl]oxy]propanamide
SMILESCOc1cc2c(NCC3CC3)c3c(nc2cc1OCCC(N)=O)CCC3
InChIInChI=1S/C20H25N3O3/c1-25-17-9-14-16(10-18(17)26-8-7-19(21)24)23-15-4-2-3-13(15)20(14)22-11-12-5-6-12/h9-10,12H,2-8,11H2,1H3,(H2,21,24)(H,22,23)
InChIKeyQTAFWGFBKNHBGQ-UHFFFAOYSA-N
MW355.44 g/mol
LogP2.81
Rot. Bonds8

About 3-[[9-(cyclopropylmethylamino)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-6-yl]oxy]propanamide

3-[[9-(cyclopropylmethylamino)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-6-yl]oxy]propanamide (PubChem CID 155284240) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is 3-[[9-(cyclopropylmethylamino)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-6-yl]oxy]propanamide.

Molecular Properties

Compound Name3-[[9-(cyclopropylmethylamino)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-6-yl]oxy]propanamide
PubChem CID155284240
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC Name3-[[9-(cyclopropylmethylamino)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-6-yl]oxy]propanamide
SMILESCOc1cc2c(NCC3CC3)c3c(nc2cc1OCCC(N)=O)CCC3
InChIInChI=1S/C20H25N3O3/c1-25-17-9-14-16(10-18(17)26-8-7-19(21)24)23-15-4-2-3-13(15)20(14)22-11-12-5-6-12/h9-10,12H,2-8,11H2,1H3,(H2,21,24)(H,22,23)
InChIKeyQTAFWGFBKNHBGQ-UHFFFAOYSA-N
XLogP2.81
TPSA86.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-[[9-(cyclopropylmethylamino)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-6-yl]oxy]propanamide with MolForge

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Related Compounds

N-(cyclopropylmethyl)-7-methoxy-6-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine;formic acid
CID 130345854
6,7-dimethoxy-N-[[(3R)-6-methylpiperidin-3-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 167287067
1-[9-(cyclopropylmethylamino)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-6-yl]ethanol
CID 166560593
3-[[[7-methoxy-6-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl]amino]methyl]-2-methylazetidine-1-carboxylic acid
CID 166664736
6,7-dimethoxy-N-propyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 62203771
6-[3-(2,5-dimethylpyrrolidin-1-yl)propoxy]-7-methoxy-N-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 155298311
N-ethyl-7-methoxy-6-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 130345777
7-methoxy-N-(2-methylpropyl)-6-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 130345712
N-cyclobutyl-7-methoxy-6-(3-pyrrolidin-1-ylpropoxy)-1,2,3,4-tetrahydroacridin-9-amine
CID 175854650
7-methoxy-N-(2-methylbutyl)-6-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 130345727
7-methoxy-N-[(1-methylcyclobutyl)methyl]-6-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 137478936
6-ethoxy-N-(1-ethylpiperidin-4-yl)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 166560804

Frequently Asked Questions

What is the IUPAC name of 3-[[9-(cyclopropylmethylamino)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-6-yl]oxy]propanamide?
The IUPAC name of 3-[[9-(cyclopropylmethylamino)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-6-yl]oxy]propanamide (CID 155284240) is 3-[[9-(cyclopropylmethylamino)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-6-yl]oxy]propanamide.
What is the SMILES notation for 3-[[9-(cyclopropylmethylamino)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-6-yl]oxy]propanamide?
The canonical SMILES for 3-[[9-(cyclopropylmethylamino)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-6-yl]oxy]propanamide is COc1cc2c(NCC3CC3)c3c(nc2cc1OCCC(N)=O)CCC3.
What is the InChIKey of 3-[[9-(cyclopropylmethylamino)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-6-yl]oxy]propanamide?
The InChIKey is QTAFWGFBKNHBGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-25-17-9-14-16(10-18(17)26-8-7-19(21)24)23-15-4-2-3-13(15)20(14)22-11-12-5-6-12/h9-10,12H,2-8,11H2,1H3,(H2,21,24)(H,22,23).
What are the key properties of 3-[[9-(cyclopropylmethylamino)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-6-yl]oxy]propanamide?
3-[[9-(cyclopropylmethylamino)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-6-yl]oxy]propanamide has a molecular weight of 355.44 g/mol, XLogP of 2.81, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[9-(cyclopropylmethylamino)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-6-yl]oxy]propanamide is sourced from PubChem (CID 155284240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).