2-[4-(3-ethoxypyrrolidin-1-yl)-2-methylquinolin-7-yl]pyridin-3-amine

C21H24N4O — CID 69306273

IUPAC2-[4-(3-ethoxypyrrolidin-1-yl)-2-methylquinolin-7-yl]pyridin-3-amine
SMILESCCOC1CCN(c2cc(C)nc3cc(-c4ncccc4N)ccc23)C1
InChIInChI=1S/C21H24N4O/c1-3-26-16-8-10-25(13-16)20-11-14(2)24-19-12-15(6-7-17(19)20)21-18(22)5-4-9-23-21/h4-7,9,11-12,16H,3,8,10,13,22H2,1-2H3
InChIKeyRNPFTAOLNZXGEV-UHFFFAOYSA-N
MW348.45 g/mol
LogP3.80
Rot. Bonds4

About 2-[4-(3-ethoxypyrrolidin-1-yl)-2-methylquinolin-7-yl]pyridin-3-amine

2-[4-(3-ethoxypyrrolidin-1-yl)-2-methylquinolin-7-yl]pyridin-3-amine (PubChem CID 69306273) has the molecular formula C21H24N4O and a molecular weight of 348.45 g/mol. Its IUPAC name is 2-[4-(3-ethoxypyrrolidin-1-yl)-2-methylquinolin-7-yl]pyridin-3-amine.

Molecular Properties

Compound Name2-[4-(3-ethoxypyrrolidin-1-yl)-2-methylquinolin-7-yl]pyridin-3-amine
PubChem CID69306273
Molecular FormulaC21H24N4O
Molecular Weight348.45 g/mol
Exact Mass348.20
IUPAC Name2-[4-(3-ethoxypyrrolidin-1-yl)-2-methylquinolin-7-yl]pyridin-3-amine
SMILESCCOC1CCN(c2cc(C)nc3cc(-c4ncccc4N)ccc23)C1
InChIInChI=1S/C21H24N4O/c1-3-26-16-8-10-25(13-16)20-11-14(2)24-19-12-15(6-7-17(19)20)21-18(22)5-4-9-23-21/h4-7,9,11-12,16H,3,8,10,13,22H2,1-2H3
InChIKeyRNPFTAOLNZXGEV-UHFFFAOYSA-N
XLogP3.80
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-Morpholin-4-ylethyl)benzo(g)quinolin-4-amine
CID 182791
3-morpholino-N-(3-nitrobenzy l)-7-(trifluoromethyl)quinolin-5-amine
CID 52937219
Quinoline, 4-(4-morpholinyl)-2-(2-pyridinyl)-
CID 453059
4-N,7-N-bis(2-aminoethyl)-1,10-phenanthroline-4,7-diamine
CID 46227409
4-(3,3-Dimethyl-6-(4-morpholinyl)-2,3-dihydro-1H-pyrrolo[3,2-b]pyridin-1-yl)-7-fluoro-3-methyl-2-(2-pyridinyl)quinoline
CID 50939338
18-Oxa-15,21-diaza-1,7-diazoniapentacyclo[20.6.2.27,14.08,13.023,28]dotriaconta-1(29),7(32),8,10,12,14(31),22(30),23,25,27-decaene diiodide
CID 67722872
N,N'-bis(7-methylquinolin-4-yl)ethane-1,2-diamine
CID 118717456
4-[1-[(1S)-1-(4-fluorophenyl)ethyl]triazolo[4,5-c]quinolin-8-yl]morpholine
CID 137646031
1,10-Phenanthroline-4,7-diamine
CID 22138387
Benzo(g)quinolin-4-amine, N-(3-(4-morpholinyl)propyl)-
CID 181834
N-[2-(Dimethylamino)ethyl]-2-(3-pyridyl)quinolin-4-amine
CID 453066
2-(4-methylphenyl)-N-(3-morpholin-4-ylpropyl)quinolin-4-amine
CID 11068428

Frequently Asked Questions

What is the IUPAC name of 2-[4-(3-ethoxypyrrolidin-1-yl)-2-methylquinolin-7-yl]pyridin-3-amine?
The IUPAC name of 2-[4-(3-ethoxypyrrolidin-1-yl)-2-methylquinolin-7-yl]pyridin-3-amine (CID 69306273) is 2-[4-(3-ethoxypyrrolidin-1-yl)-2-methylquinolin-7-yl]pyridin-3-amine.
What is the SMILES notation for 2-[4-(3-ethoxypyrrolidin-1-yl)-2-methylquinolin-7-yl]pyridin-3-amine?
The canonical SMILES for 2-[4-(3-ethoxypyrrolidin-1-yl)-2-methylquinolin-7-yl]pyridin-3-amine is CCOC1CCN(c2cc(C)nc3cc(-c4ncccc4N)ccc23)C1.
What is the InChIKey of 2-[4-(3-ethoxypyrrolidin-1-yl)-2-methylquinolin-7-yl]pyridin-3-amine?
The InChIKey is RNPFTAOLNZXGEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O/c1-3-26-16-8-10-25(13-16)20-11-14(2)24-19-12-15(6-7-17(19)20)21-18(22)5-4-9-23-21/h4-7,9,11-12,16H,3,8,10,13,22H2,1-2H3.
What are the key properties of 2-[4-(3-ethoxypyrrolidin-1-yl)-2-methylquinolin-7-yl]pyridin-3-amine?
2-[4-(3-ethoxypyrrolidin-1-yl)-2-methylquinolin-7-yl]pyridin-3-amine has a molecular weight of 348.45 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(3-ethoxypyrrolidin-1-yl)-2-methylquinolin-7-yl]pyridin-3-amine is sourced from PubChem (CID 69306273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).