N-[4-(cyclopropanecarbonylamino)-3,4-dihydropyridin-3-yl]-5-pyridin-3-yl-1H-indazole-3-carboxamide

C22H20N6O2 — CID 89450776

IUPACN-[4-(cyclopropanecarbonylamino)-3,4-dihydropyridin-3-yl]-5-pyridin-3-yl-1H-indazole-3-carboxamide
SMILESO=C(NC1C=NC=CC1NC(=O)C1CC1)c1n[nH]c2ccc(-c3cccnc3)cc12
InChIInChI=1S/C22H20N6O2/c29-21(13-3-4-13)25-18-7-9-24-12-19(18)26-22(30)20-16-10-14(5-6-17(16)27-28-20)15-2-1-8-23-11-15/h1-2,5-13,18-19H,3-4H2,(H,25,29)(H,26,30)(H,27,28)
InChIKeyNPCLTPSPKMAHEY-UHFFFAOYSA-N
MW400.44 g/mol
LogP2.22
Rot. Bonds5

About N-[4-(cyclopropanecarbonylamino)-3,4-dihydropyridin-3-yl]-5-pyridin-3-yl-1H-indazole-3-carboxamide

N-[4-(cyclopropanecarbonylamino)-3,4-dihydropyridin-3-yl]-5-pyridin-3-yl-1H-indazole-3-carboxamide (PubChem CID 89450776) has the molecular formula C22H20N6O2 and a molecular weight of 400.44 g/mol. Its IUPAC name is N-[4-(cyclopropanecarbonylamino)-3,4-dihydropyridin-3-yl]-5-pyridin-3-yl-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-[4-(cyclopropanecarbonylamino)-3,4-dihydropyridin-3-yl]-5-pyridin-3-yl-1H-indazole-3-carboxamide
PubChem CID89450776
Molecular FormulaC22H20N6O2
Molecular Weight400.44 g/mol
Exact Mass400.16
IUPAC NameN-[4-(cyclopropanecarbonylamino)-3,4-dihydropyridin-3-yl]-5-pyridin-3-yl-1H-indazole-3-carboxamide
SMILESO=C(NC1C=NC=CC1NC(=O)C1CC1)c1n[nH]c2ccc(-c3cccnc3)cc12
InChIInChI=1S/C22H20N6O2/c29-21(13-3-4-13)25-18-7-9-24-12-19(18)26-22(30)20-16-10-14(5-6-17(16)27-28-20)15-2-1-8-23-11-15/h1-2,5-13,18-19H,3-4H2,(H,25,29)(H,26,30)(H,27,28)
InChIKeyNPCLTPSPKMAHEY-UHFFFAOYSA-N
XLogP2.22
TPSA112.13 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.44
LogP ≤ 52.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-[4-(cyclopropanecarbonylamino)-3,4-dihydropyridin-3-yl]-5-pyridin-3-yl-1H-indazole-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

5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-pyridin-3-yl-1H-indazole-3-carboxamide
CID 89445547
N-[(2R)-2-phenylcyclopropyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide
CID 118390891
N-(2,3-dihydropyrazin-2-yl)-5-pyridin-3-yl-1H-indazole-3-carboxamide
CID 89451247
N-(oxan-4-ylmethyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide
CID 146241690
N-[(3S,4R)-3-fluoro-1-(2-methylpropyl)piperidin-4-yl]-5-pyridin-3-yl-1H-indazole-3-carboxamide
CID 118381227
N-(1-phenylcyclopropyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide
CID 118381215
N-[(1-propan-2-ylazetidin-3-yl)methyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide
CID 118382047
N-[4-(cyclopropanecarbonylamino)-3-pyridinyl]-5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 89458576
N-(4-cyanophenyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide
CID 89459269
N-(2,3-dimethyl-4-oxobutyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide
CID 174835213
N-(6-piperidin-1-yl-3-pyridinyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide
CID 89450862
5-pyridin-3-yl-N-[[1-(2,2,2-trifluoroethyl)azetidin-3-yl]methyl]-1H-indazole-3-carboxamide
CID 118382105

Frequently Asked Questions

What is the IUPAC name of N-[4-(cyclopropanecarbonylamino)-3,4-dihydropyridin-3-yl]-5-pyridin-3-yl-1H-indazole-3-carboxamide?
The IUPAC name of N-[4-(cyclopropanecarbonylamino)-3,4-dihydropyridin-3-yl]-5-pyridin-3-yl-1H-indazole-3-carboxamide (CID 89450776) is N-[4-(cyclopropanecarbonylamino)-3,4-dihydropyridin-3-yl]-5-pyridin-3-yl-1H-indazole-3-carboxamide.
What is the SMILES notation for N-[4-(cyclopropanecarbonylamino)-3,4-dihydropyridin-3-yl]-5-pyridin-3-yl-1H-indazole-3-carboxamide?
The canonical SMILES for N-[4-(cyclopropanecarbonylamino)-3,4-dihydropyridin-3-yl]-5-pyridin-3-yl-1H-indazole-3-carboxamide is O=C(NC1C=NC=CC1NC(=O)C1CC1)c1n[nH]c2ccc(-c3cccnc3)cc12.
What is the InChIKey of N-[4-(cyclopropanecarbonylamino)-3,4-dihydropyridin-3-yl]-5-pyridin-3-yl-1H-indazole-3-carboxamide?
The InChIKey is NPCLTPSPKMAHEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N6O2/c29-21(13-3-4-13)25-18-7-9-24-12-19(18)26-22(30)20-16-10-14(5-6-17(16)27-28-20)15-2-1-8-23-11-15/h1-2,5-13,18-19H,3-4H2,(H,25,29)(H,26,30)(H,27,28).
What are the key properties of N-[4-(cyclopropanecarbonylamino)-3,4-dihydropyridin-3-yl]-5-pyridin-3-yl-1H-indazole-3-carboxamide?
N-[4-(cyclopropanecarbonylamino)-3,4-dihydropyridin-3-yl]-5-pyridin-3-yl-1H-indazole-3-carboxamide has a molecular weight of 400.44 g/mol, XLogP of 2.22, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(cyclopropanecarbonylamino)-3,4-dihydropyridin-3-yl]-5-pyridin-3-yl-1H-indazole-3-carboxamide is sourced from PubChem (CID 89450776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).