N-[4-(cyclopropanecarbonylamino)-3-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide

C28H29N7O2 — CID 89458579

IUPACN-[4-(cyclopropanecarbonylamino)-3-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
SMILESO=C(Nc1cnccc1NC(=O)C1CC1)c1n[nH]c2ccc(-c3cncc(CN4CCCCC4)c3)cc12
InChIInChI=1S/C28H29N7O2/c36-27(19-4-5-19)31-24-8-9-29-16-25(24)32-28(37)26-22-13-20(6-7-23(22)33-34-26)21-12-18(14-30-15-21)17-35-10-2-1-3-11-35/h6-9,12-16,19H,1-5,10-11,17H2,(H,32,37)(H,33,34)(H,29,31,36)
InChIKeyDLBLWFYPWSQYDL-UHFFFAOYSA-N
MW495.59 g/mol
LogP4.61
Rot. Bonds7

About N-[4-(cyclopropanecarbonylamino)-3-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide

N-[4-(cyclopropanecarbonylamino)-3-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide (PubChem CID 89458579) has the molecular formula C28H29N7O2 and a molecular weight of 495.59 g/mol. Its IUPAC name is N-[4-(cyclopropanecarbonylamino)-3-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-[4-(cyclopropanecarbonylamino)-3-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
PubChem CID89458579
Molecular FormulaC28H29N7O2
Molecular Weight495.59 g/mol
Exact Mass495.24
IUPAC NameN-[4-(cyclopropanecarbonylamino)-3-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
SMILESO=C(Nc1cnccc1NC(=O)C1CC1)c1n[nH]c2ccc(-c3cncc(CN4CCCCC4)c3)cc12
InChIInChI=1S/C28H29N7O2/c36-27(19-4-5-19)31-24-8-9-29-16-25(24)32-28(37)26-22-13-20(6-7-23(22)33-34-26)21-12-18(14-30-15-21)17-35-10-2-1-3-11-35/h6-9,12-16,19H,1-5,10-11,17H2,(H,32,37)(H,33,34)(H,29,31,36)
InChIKeyDLBLWFYPWSQYDL-UHFFFAOYSA-N
XLogP4.61
TPSA115.90 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms37
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500495.59
LogP ≤ 54.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze N-[4-(cyclopropanecarbonylamino)-3-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-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

Frequently Asked Questions

What is the IUPAC name of N-[4-(cyclopropanecarbonylamino)-3-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide?
The IUPAC name of N-[4-(cyclopropanecarbonylamino)-3-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide (CID 89458579) is N-[4-(cyclopropanecarbonylamino)-3-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide.
What is the SMILES notation for N-[4-(cyclopropanecarbonylamino)-3-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide?
The canonical SMILES for N-[4-(cyclopropanecarbonylamino)-3-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide is O=C(Nc1cnccc1NC(=O)C1CC1)c1n[nH]c2ccc(-c3cncc(CN4CCCCC4)c3)cc12.
What is the InChIKey of N-[4-(cyclopropanecarbonylamino)-3-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide?
The InChIKey is DLBLWFYPWSQYDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H29N7O2/c36-27(19-4-5-19)31-24-8-9-29-16-25(24)32-28(37)26-22-13-20(6-7-23(22)33-34-26)21-12-18(14-30-15-21)17-35-10-2-1-3-11-35/h6-9,12-16,19H,1-5,10-11,17H2,(H,32,37)(H,33,34)(H,29,31,36).
What are the key properties of N-[4-(cyclopropanecarbonylamino)-3-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide?
N-[4-(cyclopropanecarbonylamino)-3-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide has a molecular weight of 495.59 g/mol, XLogP of 4.61, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(cyclopropanecarbonylamino)-3-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 89458579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).