N-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]pyrazolo[1,5-a]pyridine-2-carboxamide

C23H29N5O — CID 11523990

IUPACN-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]pyrazolo[1,5-a]pyridine-2-carboxamide
SMILESCc1ccccc1N1CCN(CCCCNC(=O)c2cc3ccccn3n2)CC1
InChIInChI=1S/C23H29N5O/c1-19-8-2-3-10-22(19)27-16-14-26(15-17-27)12-7-5-11-24-23(29)21-18-20-9-4-6-13-28(20)25-21/h2-4,6,8-10,13,18H,5,7,11-12,14-17H2,1H3,(H,24,29)
InChIKeyDNQGSKFJMTWDHI-UHFFFAOYSA-N
MW391.52 g/mol
LogP2.97
Rot. Bonds7

About N-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]pyrazolo[1,5-a]pyridine-2-carboxamide

N-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]pyrazolo[1,5-a]pyridine-2-carboxamide (PubChem CID 11523990) has the molecular formula C23H29N5O and a molecular weight of 391.52 g/mol. Its IUPAC name is N-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]pyrazolo[1,5-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]pyrazolo[1,5-a]pyridine-2-carboxamide
PubChem CID11523990
Molecular FormulaC23H29N5O
Molecular Weight391.52 g/mol
Exact Mass391.24
IUPAC NameN-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]pyrazolo[1,5-a]pyridine-2-carboxamide
SMILESCc1ccccc1N1CCN(CCCCNC(=O)c2cc3ccccn3n2)CC1
InChIInChI=1S/C23H29N5O/c1-19-8-2-3-10-22(19)27-16-14-26(15-17-27)12-7-5-11-24-23(29)21-18-20-9-4-6-13-28(20)25-21/h2-4,6,8-10,13,18H,5,7,11-12,14-17H2,1H3,(H,24,29)
InChIKeyDNQGSKFJMTWDHI-UHFFFAOYSA-N
XLogP2.97
TPSA52.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.52
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[4-[4-(2-phenylphenyl)piperazin-1-yl]butyl]pyrazolo[1,5-a]pyridine-2-carboxamide
CID 11648148
N-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butyl]pyrazolo[1,5-a]pyridine-2-carboxamide
CID 11662289
N-[3-[4-(2-methylphenyl)piperazin-1-yl]propyl]pyridine-4-carboxamide
CID 127042302
N-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butyl]anthracene-2-carboxamide;hydrochloride
CID 21202821
3,4-dichloro-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]benzamide
CID 15050919
N-(2-thiophen-2-ylethyl)pyrazolo[1,5-a]pyridine-2-carboxamide
CID 46287294
2-(2-methylphenyl)-1,3-dioxo-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]isoindole-5-carboxamide
CID 39540741
3-[(2-fluorobenzoyl)amino]-4-[4-(2-methylphenyl)piperazin-1-yl]-N-(3-pyrrolidin-1-ylpropyl)benzamide
CID 130372829
N-[5-(butylcarbamoyl)-2-[4-(2-methylphenyl)piperazin-1-yl]phenyl]-2-methyl-1,3-oxazole-4-carboxamide
CID 130372949
N-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butyl]-1-ethyl-2-methyl-5-phenylpyrrole-3-carboxamide
CID 45279304
N-[4-[4-(3-chloro-2-methylphenyl)piperazin-1-yl]butyl]anthracene-2-carboxamide;dihydrochloride
CID 21202835
N-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl]-6-methyl-2-methylsulfanylpyrimidine-4-carboxamide
CID 50899749

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]pyrazolo[1,5-a]pyridine-2-carboxamide?
The IUPAC name of N-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]pyrazolo[1,5-a]pyridine-2-carboxamide (CID 11523990) is N-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]pyrazolo[1,5-a]pyridine-2-carboxamide.
What is the SMILES notation for N-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]pyrazolo[1,5-a]pyridine-2-carboxamide?
The canonical SMILES for N-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]pyrazolo[1,5-a]pyridine-2-carboxamide is Cc1ccccc1N1CCN(CCCCNC(=O)c2cc3ccccn3n2)CC1.
What is the InChIKey of N-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]pyrazolo[1,5-a]pyridine-2-carboxamide?
The InChIKey is DNQGSKFJMTWDHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N5O/c1-19-8-2-3-10-22(19)27-16-14-26(15-17-27)12-7-5-11-24-23(29)21-18-20-9-4-6-13-28(20)25-21/h2-4,6,8-10,13,18H,5,7,11-12,14-17H2,1H3,(H,24,29).
What are the key properties of N-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]pyrazolo[1,5-a]pyridine-2-carboxamide?
N-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]pyrazolo[1,5-a]pyridine-2-carboxamide has a molecular weight of 391.52 g/mol, XLogP of 2.97, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]pyrazolo[1,5-a]pyridine-2-carboxamide is sourced from PubChem (CID 11523990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).