2-(dimethylamino)-N-[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]acetamide

C24H24N6O — CID 10179913

IUPAC2-(dimethylamino)-N-[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]acetamide
SMILESCN(C)CC(=O)Nc1ccc2c(-c3c(-c4ccccn4)nn4c3CCC4)ccnc2c1
InChIInChI=1S/C24H24N6O/c1-29(2)15-22(31)27-16-8-9-17-18(10-12-26-20(17)14-16)23-21-7-5-13-30(21)28-24(23)19-6-3-4-11-25-19/h3-4,6,8-12,14H,5,7,13,15H2,1-2H3,(H,27,31)
InChIKeyDOEJDSZHAQGKIQ-UHFFFAOYSA-N
MW412.50 g/mol
LogP3.61
Rot. Bonds5

About 2-(dimethylamino)-N-[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]acetamide

2-(dimethylamino)-N-[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]acetamide (PubChem CID 10179913) has the molecular formula C24H24N6O and a molecular weight of 412.50 g/mol. Its IUPAC name is 2-(dimethylamino)-N-[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]acetamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]acetamide
PubChem CID10179913
Molecular FormulaC24H24N6O
Molecular Weight412.50 g/mol
Exact Mass412.20
IUPAC Name2-(dimethylamino)-N-[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]acetamide
SMILESCN(C)CC(=O)Nc1ccc2c(-c3c(-c4ccccn4)nn4c3CCC4)ccnc2c1
InChIInChI=1S/C24H24N6O/c1-29(2)15-22(31)27-16-8-9-17-18(10-12-26-20(17)14-16)23-21-7-5-13-30(21)28-24(23)19-6-3-4-11-25-19/h3-4,6,8-12,14H,5,7,13,15H2,1-2H3,(H,27,31)
InChIKeyDOEJDSZHAQGKIQ-UHFFFAOYSA-N
XLogP3.61
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.50
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

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4-(2-(6-methylpyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinoline-7-carboxamide
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CID 126970680
US11213520, Example I-015
CID 139519627
7-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-N-(2-phenyl-4-pyridinyl)quinolin-4-amine
CID 164628562
N-[[5-(2,6-difluorophenyl)-2-pyridinyl]methyl]-2-(12-fluoro-5,6,16-triazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),2,4,10(15),11,13-hexaen-16-yl)acetamide
CID 121277778
N-(4-(2-(pyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl)acetamide
CID 9969336
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CID 10131416
1-(2-(dimethylamino)ethyl)-3-(4-(2-(pyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl)urea
CID 10203695
N-(4-(4-(3-(pyridin-2-yl)-1H-pyrazol-4-yl)pyridin-2-yl)phenyl)-2-(pyrrolidin-1-yl)acetamide
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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]acetamide?
The IUPAC name of 2-(dimethylamino)-N-[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]acetamide (CID 10179913) is 2-(dimethylamino)-N-[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]acetamide.
What is the SMILES notation for 2-(dimethylamino)-N-[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]acetamide?
The canonical SMILES for 2-(dimethylamino)-N-[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]acetamide is CN(C)CC(=O)Nc1ccc2c(-c3c(-c4ccccn4)nn4c3CCC4)ccnc2c1.
What is the InChIKey of 2-(dimethylamino)-N-[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]acetamide?
The InChIKey is DOEJDSZHAQGKIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N6O/c1-29(2)15-22(31)27-16-8-9-17-18(10-12-26-20(17)14-16)23-21-7-5-13-30(21)28-24(23)19-6-3-4-11-25-19/h3-4,6,8-12,14H,5,7,13,15H2,1-2H3,(H,27,31).
What are the key properties of 2-(dimethylamino)-N-[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]acetamide?
2-(dimethylamino)-N-[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]acetamide has a molecular weight of 412.50 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]acetamide is sourced from PubChem (CID 10179913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).