N-[2-[4-(methanesulfonamido)piperidin-1-yl]ethyl]-1-propan-2-ylindazole-3-carboxamide

C19H29N5O3S — CID 10835246

IUPACN-[2-[4-(methanesulfonamido)piperidin-1-yl]ethyl]-1-propan-2-ylindazole-3-carboxamide
SMILESCC(C)n1nc(C(=O)NCCN2CCC(NS(C)(=O)=O)CC2)c2ccccc21
InChIInChI=1S/C19H29N5O3S/c1-14(2)24-17-7-5-4-6-16(17)18(21-24)19(25)20-10-13-23-11-8-15(9-12-23)22-28(3,26)27/h4-7,14-15,22H,8-13H2,1-3H3,(H,20,25)
InChIKeyJQCGFECKYINYIU-UHFFFAOYSA-N
MW407.54 g/mol
LogP1.36
Rot. Bonds7

About N-[2-[4-(methanesulfonamido)piperidin-1-yl]ethyl]-1-propan-2-ylindazole-3-carboxamide

N-[2-[4-(methanesulfonamido)piperidin-1-yl]ethyl]-1-propan-2-ylindazole-3-carboxamide (PubChem CID 10835246) has the molecular formula C19H29N5O3S and a molecular weight of 407.54 g/mol. Its IUPAC name is N-[2-[4-(methanesulfonamido)piperidin-1-yl]ethyl]-1-propan-2-ylindazole-3-carboxamide.

Molecular Properties

Compound NameN-[2-[4-(methanesulfonamido)piperidin-1-yl]ethyl]-1-propan-2-ylindazole-3-carboxamide
PubChem CID10835246
Molecular FormulaC19H29N5O3S
Molecular Weight407.54 g/mol
Exact Mass407.20
IUPAC NameN-[2-[4-(methanesulfonamido)piperidin-1-yl]ethyl]-1-propan-2-ylindazole-3-carboxamide
SMILESCC(C)n1nc(C(=O)NCCN2CCC(NS(C)(=O)=O)CC2)c2ccccc21
InChIInChI=1S/C19H29N5O3S/c1-14(2)24-17-7-5-4-6-16(17)18(21-24)19(25)20-10-13-23-11-8-15(9-12-23)22-28(3,26)27/h4-7,14-15,22H,8-13H2,1-3H3,(H,20,25)
InChIKeyJQCGFECKYINYIU-UHFFFAOYSA-N
XLogP1.36
TPSA96.33 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.54
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[2-[4-(methanesulfonamido)piperidin-1-yl]ethyl]-1-propan-2-ylindazole-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-[2-[4-(methanesulfonamido)piperidin-1-yl]ethyl]-1-propan-2-ylindazole-3-carboxamide?
The IUPAC name of N-[2-[4-(methanesulfonamido)piperidin-1-yl]ethyl]-1-propan-2-ylindazole-3-carboxamide (CID 10835246) is N-[2-[4-(methanesulfonamido)piperidin-1-yl]ethyl]-1-propan-2-ylindazole-3-carboxamide.
What is the SMILES notation for N-[2-[4-(methanesulfonamido)piperidin-1-yl]ethyl]-1-propan-2-ylindazole-3-carboxamide?
The canonical SMILES for N-[2-[4-(methanesulfonamido)piperidin-1-yl]ethyl]-1-propan-2-ylindazole-3-carboxamide is CC(C)n1nc(C(=O)NCCN2CCC(NS(C)(=O)=O)CC2)c2ccccc21.
What is the InChIKey of N-[2-[4-(methanesulfonamido)piperidin-1-yl]ethyl]-1-propan-2-ylindazole-3-carboxamide?
The InChIKey is JQCGFECKYINYIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N5O3S/c1-14(2)24-17-7-5-4-6-16(17)18(21-24)19(25)20-10-13-23-11-8-15(9-12-23)22-28(3,26)27/h4-7,14-15,22H,8-13H2,1-3H3,(H,20,25).
What are the key properties of N-[2-[4-(methanesulfonamido)piperidin-1-yl]ethyl]-1-propan-2-ylindazole-3-carboxamide?
N-[2-[4-(methanesulfonamido)piperidin-1-yl]ethyl]-1-propan-2-ylindazole-3-carboxamide has a molecular weight of 407.54 g/mol, XLogP of 1.36, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(methanesulfonamido)piperidin-1-yl]ethyl]-1-propan-2-ylindazole-3-carboxamide is sourced from PubChem (CID 10835246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).