N-[3-[(4-methyl-1H-indazol-5-yl)oxy]cyclohexyl]cyclopentanecarboxamide

C20H27N3O2 — CID 18447471

IUPACN-[3-[(4-methyl-1H-indazol-5-yl)oxy]cyclohexyl]cyclopentanecarboxamide
SMILESCc1c(OC2CCCC(NC(=O)C3CCCC3)C2)ccc2[nH]ncc12
InChIInChI=1S/C20H27N3O2/c1-13-17-12-21-23-18(17)9-10-19(13)25-16-8-4-7-15(11-16)22-20(24)14-5-2-3-6-14/h9-10,12,14-16H,2-8,11H2,1H3,(H,21,23)(H,22,24)
InChIKeyKHURAMSJTMCIQO-UHFFFAOYSA-N
MW341.45 g/mol
LogP3.87
Rot. Bonds4

About N-[3-[(4-methyl-1H-indazol-5-yl)oxy]cyclohexyl]cyclopentanecarboxamide

N-[3-[(4-methyl-1H-indazol-5-yl)oxy]cyclohexyl]cyclopentanecarboxamide (PubChem CID 18447471) has the molecular formula C20H27N3O2 and a molecular weight of 341.45 g/mol. Its IUPAC name is N-[3-[(4-methyl-1H-indazol-5-yl)oxy]cyclohexyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[3-[(4-methyl-1H-indazol-5-yl)oxy]cyclohexyl]cyclopentanecarboxamide
PubChem CID18447471
Molecular FormulaC20H27N3O2
Molecular Weight341.45 g/mol
Exact Mass341.21
IUPAC NameN-[3-[(4-methyl-1H-indazol-5-yl)oxy]cyclohexyl]cyclopentanecarboxamide
SMILESCc1c(OC2CCCC(NC(=O)C3CCCC3)C2)ccc2[nH]ncc12
InChIInChI=1S/C20H27N3O2/c1-13-17-12-21-23-18(17)9-10-19(13)25-16-8-4-7-15(11-16)22-20(24)14-5-2-3-6-14/h9-10,12,14-16H,2-8,11H2,1H3,(H,21,23)(H,22,24)
InChIKeyKHURAMSJTMCIQO-UHFFFAOYSA-N
XLogP3.87
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.45
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[3-[(4-methyl-1H-indazol-5-yl)oxy]cyclohexyl]cyclopentanecarboxamide?
The IUPAC name of N-[3-[(4-methyl-1H-indazol-5-yl)oxy]cyclohexyl]cyclopentanecarboxamide (CID 18447471) is N-[3-[(4-methyl-1H-indazol-5-yl)oxy]cyclohexyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[3-[(4-methyl-1H-indazol-5-yl)oxy]cyclohexyl]cyclopentanecarboxamide?
The canonical SMILES for N-[3-[(4-methyl-1H-indazol-5-yl)oxy]cyclohexyl]cyclopentanecarboxamide is Cc1c(OC2CCCC(NC(=O)C3CCCC3)C2)ccc2[nH]ncc12.
What is the InChIKey of N-[3-[(4-methyl-1H-indazol-5-yl)oxy]cyclohexyl]cyclopentanecarboxamide?
The InChIKey is KHURAMSJTMCIQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O2/c1-13-17-12-21-23-18(17)9-10-19(13)25-16-8-4-7-15(11-16)22-20(24)14-5-2-3-6-14/h9-10,12,14-16H,2-8,11H2,1H3,(H,21,23)(H,22,24).
What are the key properties of N-[3-[(4-methyl-1H-indazol-5-yl)oxy]cyclohexyl]cyclopentanecarboxamide?
N-[3-[(4-methyl-1H-indazol-5-yl)oxy]cyclohexyl]cyclopentanecarboxamide has a molecular weight of 341.45 g/mol, XLogP of 3.87, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(4-methyl-1H-indazol-5-yl)oxy]cyclohexyl]cyclopentanecarboxamide is sourced from PubChem (CID 18447471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).