6,7-dimethoxy-N-[[(3R)-6-methylpiperidin-3-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine

C21H29N3O2 — CID 167287067

IUPAC6,7-dimethoxy-N-[[(3R)-6-methylpiperidin-3-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
SMILESCOc1cc2nc3c(c(NC[C@@H]4CCC(C)NC4)c2cc1OC)CCC3
InChIInChI=1S/C21H29N3O2/c1-13-7-8-14(11-22-13)12-23-21-15-5-4-6-17(15)24-18-10-20(26-3)19(25-2)9-16(18)21/h9-10,13-14,22H,4-8,11-12H2,1-3H3,(H,23,24)/t13?,14-/m1/s1
InChIKeyPLQIPEXKZUGZFO-ARLHGKGLSA-N
MW355.48 g/mol
LogP3.54
Rot. Bonds5

About 6,7-dimethoxy-N-[[(3R)-6-methylpiperidin-3-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine

6,7-dimethoxy-N-[[(3R)-6-methylpiperidin-3-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine (PubChem CID 167287067) has the molecular formula C21H29N3O2 and a molecular weight of 355.48 g/mol. Its IUPAC name is 6,7-dimethoxy-N-[[(3R)-6-methylpiperidin-3-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine.

Molecular Properties

Compound Name6,7-dimethoxy-N-[[(3R)-6-methylpiperidin-3-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
PubChem CID167287067
Molecular FormulaC21H29N3O2
Molecular Weight355.48 g/mol
Exact Mass355.23
IUPAC Name6,7-dimethoxy-N-[[(3R)-6-methylpiperidin-3-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
SMILESCOc1cc2nc3c(c(NC[C@@H]4CCC(C)NC4)c2cc1OC)CCC3
InChIInChI=1S/C21H29N3O2/c1-13-7-8-14(11-22-13)12-23-21-15-5-4-6-17(15)24-18-10-20(26-3)19(25-2)9-16(18)21/h9-10,13-14,22H,4-8,11-12H2,1-3H3,(H,23,24)/t13?,14-/m1/s1
InChIKeyPLQIPEXKZUGZFO-ARLHGKGLSA-N
XLogP3.54
TPSA55.41 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.48
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6,7-dimethoxy-N-[[(3R)-6-methylpiperidin-3-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine with MolForge

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Launch Full Analysis

Related Compounds

1-[9-(cyclopropylmethylamino)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-6-yl]ethanol
CID 166560593
3-[[9-(cyclopropylmethylamino)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-6-yl]oxy]propanamide
CID 155284240
6,7-dimethoxy-N-propyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 62203771
N-(cyclopropylmethyl)-7-methoxy-6-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine;formic acid
CID 130345854
6-[3-(2,5-dimethylpyrrolidin-1-yl)propoxy]-7-methoxy-N-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 155298311
N-[(3S)-1-cyclobutylpyrrolidin-3-yl]-6,7-dimethoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 166560553
6-ethoxy-N-(1-ethylpiperidin-4-yl)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 166560804
N-ethyl-6-fluoro-7-methoxy-1,2,3,4-tetrahydroacridin-9-amine
CID 103996744
2-[4-[(6,7-dimethoxy-1,2,3,4-tetrahydroacridin-9-yl)amino]piperidin-1-yl]ethanol
CID 147327134
N-ethyl-7-methoxy-6-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 130345777
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
N-cyclobutyl-7-methoxy-6-(3-pyrrolidin-1-ylpropoxy)-1,2,3,4-tetrahydroacridin-9-amine
CID 175854650

Frequently Asked Questions

What is the IUPAC name of 6,7-dimethoxy-N-[[(3R)-6-methylpiperidin-3-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The IUPAC name of 6,7-dimethoxy-N-[[(3R)-6-methylpiperidin-3-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine (CID 167287067) is 6,7-dimethoxy-N-[[(3R)-6-methylpiperidin-3-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine.
What is the SMILES notation for 6,7-dimethoxy-N-[[(3R)-6-methylpiperidin-3-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The canonical SMILES for 6,7-dimethoxy-N-[[(3R)-6-methylpiperidin-3-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine is COc1cc2nc3c(c(NC[C@@H]4CCC(C)NC4)c2cc1OC)CCC3.
What is the InChIKey of 6,7-dimethoxy-N-[[(3R)-6-methylpiperidin-3-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The InChIKey is PLQIPEXKZUGZFO-ARLHGKGLSA-N. The full InChI is InChI=1S/C21H29N3O2/c1-13-7-8-14(11-22-13)12-23-21-15-5-4-6-17(15)24-18-10-20(26-3)19(25-2)9-16(18)21/h9-10,13-14,22H,4-8,11-12H2,1-3H3,(H,23,24)/t13?,14-/m1/s1.
What are the key properties of 6,7-dimethoxy-N-[[(3R)-6-methylpiperidin-3-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
6,7-dimethoxy-N-[[(3R)-6-methylpiperidin-3-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine has a molecular weight of 355.48 g/mol, XLogP of 3.54, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethoxy-N-[[(3R)-6-methylpiperidin-3-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine is sourced from PubChem (CID 167287067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).