N-[3-(dimethylamino)propyl]-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide

C22H24N6O — CID 97362124

IUPACN-[3-(dimethylamino)propyl]-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide
SMILESCN(C)CCCNC(=O)c1ccn(-c2ccc3ccc(-c4ccncc4)cn23)n1
InChIInChI=1S/C22H24N6O/c1-26(2)14-3-11-24-22(29)20-10-15-28(25-20)21-7-6-19-5-4-18(16-27(19)21)17-8-12-23-13-9-17/h4-10,12-13,15-16H,3,11,14H2,1-2H3,(H,24,29)
InChIKeyLBNQSRSUVAMEIP-UHFFFAOYSA-N
MW388.48 g/mol
LogP2.87
Rot. Bonds7

About N-[3-(dimethylamino)propyl]-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide

N-[3-(dimethylamino)propyl]-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide (PubChem CID 97362124) has the molecular formula C22H24N6O and a molecular weight of 388.48 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide
PubChem CID97362124
Molecular FormulaC22H24N6O
Molecular Weight388.48 g/mol
Exact Mass388.20
IUPAC NameN-[3-(dimethylamino)propyl]-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide
SMILESCN(C)CCCNC(=O)c1ccn(-c2ccc3ccc(-c4ccncc4)cn23)n1
InChIInChI=1S/C22H24N6O/c1-26(2)14-3-11-24-22(29)20-10-15-28(25-20)21-7-6-19-5-4-18(16-27(19)21)17-8-12-23-13-9-17/h4-10,12-13,15-16H,3,11,14H2,1-2H3,(H,24,29)
InChIKeyLBNQSRSUVAMEIP-UHFFFAOYSA-N
XLogP2.87
TPSA67.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.48
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[3-(dimethylamino)propyl]-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide 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

N-[2-(dimethylamino)ethyl]-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide
CID 97447361
N-propyl-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide
CID 97447362
N-butyl-N-methyl-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide
CID 97362117
1-[6-(4-fluorophenyl)indolizin-3-yl]-N-(2-methoxyethyl)pyrazole-3-carboxamide
CID 97447425
1-(6-phenylindolizin-3-yl)-N-(2-pyridin-3-ylethyl)pyrazole-3-carboxamide
CID 97447325
N-(6-methyl-3-pyridinyl)-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide
CID 97362114
N-[2-(dimethylamino)-2-oxoethyl]-1-(6-pyridin-3-ylindolizin-3-yl)pyrazole-3-carboxamide
CID 97410713
N-[(4-chlorophenyl)methyl]-1-(6-phenylindolizin-3-yl)pyrazole-3-carboxamide
CID 97362092
1-[6-(3-methoxyphenyl)indolizin-3-yl]-N-(2-pyridin-3-ylethyl)pyrazole-3-carboxamide
CID 97447454
1-indolizin-3-yl-N-(3-methoxypropyl)pyrazole-3-carboxamide
CID 97362064
1-[6-(1-methylpyrazol-4-yl)indolizin-3-yl]-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide
CID 97447388
N-[3-(dimethylamino)propyl]pyridine-4-carboxamide;hydrochloride
CID 110755338

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide?
The IUPAC name of N-[3-(dimethylamino)propyl]-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide (CID 97362124) is N-[3-(dimethylamino)propyl]-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide.
What is the SMILES notation for N-[3-(dimethylamino)propyl]-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide?
The canonical SMILES for N-[3-(dimethylamino)propyl]-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide is CN(C)CCCNC(=O)c1ccn(-c2ccc3ccc(-c4ccncc4)cn23)n1.
What is the InChIKey of N-[3-(dimethylamino)propyl]-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide?
The InChIKey is LBNQSRSUVAMEIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N6O/c1-26(2)14-3-11-24-22(29)20-10-15-28(25-20)21-7-6-19-5-4-18(16-27(19)21)17-8-12-23-13-9-17/h4-10,12-13,15-16H,3,11,14H2,1-2H3,(H,24,29).
What are the key properties of N-[3-(dimethylamino)propyl]-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide?
N-[3-(dimethylamino)propyl]-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide has a molecular weight of 388.48 g/mol, XLogP of 2.87, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide is sourced from PubChem (CID 97362124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).