N-[5-[4-(3,4-dichlorophenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide;ethane

C22H26Cl2N6O — CID 143929704

IUPACN-[5-[4-(3,4-dichlorophenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide;ethane
SMILESCC.O=C(Nc1nc2cccc(N3CCN(c4ccc(Cl)c(Cl)c4)CC3)n2n1)C1CC1
InChIInChI=1S/C20H20Cl2N6O.C2H6/c21-15-7-6-14(12-16(15)22)26-8-10-27(11-9-26)18-3-1-2-17-23-20(25-28(17)18)24-19(29)13-4-5-13;1-2/h1-3,6-7,12-13H,4-5,8-11H2,(H,24,25,29);1-2H3
InChIKeyUFTYLHIVFCYQMO-UHFFFAOYSA-N
MW461.40 g/mol
LogP4.74
Rot. Bonds4

About N-[5-[4-(3,4-dichlorophenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide;ethane

N-[5-[4-(3,4-dichlorophenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide;ethane (PubChem CID 143929704) has the molecular formula C22H26Cl2N6O and a molecular weight of 461.40 g/mol. Its IUPAC name is N-[5-[4-(3,4-dichlorophenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide;ethane.

Molecular Properties

Compound NameN-[5-[4-(3,4-dichlorophenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide;ethane
PubChem CID143929704
Molecular FormulaC22H26Cl2N6O
Molecular Weight461.40 g/mol
Exact Mass460.15
IUPAC NameN-[5-[4-(3,4-dichlorophenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide;ethane
SMILESCC.O=C(Nc1nc2cccc(N3CCN(c4ccc(Cl)c(Cl)c4)CC3)n2n1)C1CC1
InChIInChI=1S/C20H20Cl2N6O.C2H6/c21-15-7-6-14(12-16(15)22)26-8-10-27(11-9-26)18-3-1-2-17-23-20(25-28(17)18)24-19(29)13-4-5-13;1-2/h1-3,6-7,12-13H,4-5,8-11H2,(H,24,25,29);1-2H3
InChIKeyUFTYLHIVFCYQMO-UHFFFAOYSA-N
XLogP4.74
TPSA65.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500461.40
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[5-[4-(3,4-dichlorophenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide;ethane 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

3-[4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]piperazin-1-yl]benzoic acid
CID 70929702
4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N-(4-piperidin-1-ylphenyl)piperazine-1-carboxamide
CID 70929649
N-[5-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
CID 91090467
N-[5-[4-[(2,3-dichlorophenyl)sulfanylamino]piperidin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
CID 143929700
N-[5-[4-(ethoxymethyl)piperidin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
CID 44622130
N-[5-(4-benzyl-4-hydroxypiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
CID 44622594
N-[5-[4-[2-(dipropylamino)ethyl]piperidin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
CID 70929386
N-[5-[4-[(3-cyanophenyl)methyl]piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
CID 70929698
N-[5-(3-oxopiperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
CID 70929601
N-[5-[4-(2-pyridin-3-ylacetyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
CID 70929717
N-[5-(2,4-dichlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
CID 54771546
tert-butyl 4-[4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenyl]piperazine-1-carboxylate
CID 59589819

Frequently Asked Questions

What is the IUPAC name of N-[5-[4-(3,4-dichlorophenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide;ethane?
The IUPAC name of N-[5-[4-(3,4-dichlorophenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide;ethane (CID 143929704) is N-[5-[4-(3,4-dichlorophenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide;ethane.
What is the SMILES notation for N-[5-[4-(3,4-dichlorophenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide;ethane?
The canonical SMILES for N-[5-[4-(3,4-dichlorophenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide;ethane is CC.O=C(Nc1nc2cccc(N3CCN(c4ccc(Cl)c(Cl)c4)CC3)n2n1)C1CC1.
What is the InChIKey of N-[5-[4-(3,4-dichlorophenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide;ethane?
The InChIKey is UFTYLHIVFCYQMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20Cl2N6O.C2H6/c21-15-7-6-14(12-16(15)22)26-8-10-27(11-9-26)18-3-1-2-17-23-20(25-28(17)18)24-19(29)13-4-5-13;1-2/h1-3,6-7,12-13H,4-5,8-11H2,(H,24,25,29);1-2H3.
What are the key properties of N-[5-[4-(3,4-dichlorophenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide;ethane?
N-[5-[4-(3,4-dichlorophenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide;ethane has a molecular weight of 461.40 g/mol, XLogP of 4.74, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[4-(3,4-dichlorophenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide;ethane is sourced from PubChem (CID 143929704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).