N-[(1R)-1-cyclohexylethyl]-3-ethoxy-2-(2-methoxyethyl)indazole-6-carboxamide

C21H31N3O3 — CID 11958403

IUPACN-[(1R)-1-cyclohexylethyl]-3-ethoxy-2-(2-methoxyethyl)indazole-6-carboxamide
SMILESCCOc1c2ccc(C(=O)N[C@H](C)C3CCCCC3)cc2nn1CCOC
InChIInChI=1S/C21H31N3O3/c1-4-27-21-18-11-10-17(14-19(18)23-24(21)12-13-26-3)20(25)22-15(2)16-8-6-5-7-9-16/h10-11,14-16H,4-9,12-13H2,1-3H3,(H,22,25)/t15-/m1/s1
InChIKeyZWWSSORPFHFYDR-OAHLLOKOSA-N
MW373.50 g/mol
LogP3.78
Rot. Bonds8

About N-[(1R)-1-cyclohexylethyl]-3-ethoxy-2-(2-methoxyethyl)indazole-6-carboxamide

N-[(1R)-1-cyclohexylethyl]-3-ethoxy-2-(2-methoxyethyl)indazole-6-carboxamide (PubChem CID 11958403) has the molecular formula C21H31N3O3 and a molecular weight of 373.50 g/mol. Its IUPAC name is N-[(1R)-1-cyclohexylethyl]-3-ethoxy-2-(2-methoxyethyl)indazole-6-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-cyclohexylethyl]-3-ethoxy-2-(2-methoxyethyl)indazole-6-carboxamide
PubChem CID11958403
Molecular FormulaC21H31N3O3
Molecular Weight373.50 g/mol
Exact Mass373.24
IUPAC NameN-[(1R)-1-cyclohexylethyl]-3-ethoxy-2-(2-methoxyethyl)indazole-6-carboxamide
SMILESCCOc1c2ccc(C(=O)N[C@H](C)C3CCCCC3)cc2nn1CCOC
InChIInChI=1S/C21H31N3O3/c1-4-27-21-18-11-10-17(14-19(18)23-24(21)12-13-26-3)20(25)22-15(2)16-8-6-5-7-9-16/h10-11,14-16H,4-9,12-13H2,1-3H3,(H,22,25)/t15-/m1/s1
InChIKeyZWWSSORPFHFYDR-OAHLLOKOSA-N
XLogP3.78
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.50
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-butyl-N-(cyclopropylmethyl)-3-ethoxyindazole-6-carboxamide
CID 11958407
N-cycloheptyl-3-methoxy-2-methylindazole-6-carboxamide
CID 90609130
N-[(1S)-1-cyclohexylethyl]-2-[4-[[(1S)-1-cyclohexylethyl]carbamoyl]-2-pyridinyl]pyridine-4-carboxamide
CID 132516828
N-[(1S)-1-cyclohexylethyl]-4-[4-[[(1S)-1-cyclohexylethyl]carbamoyl]phenyl]benzamide
CID 132596984
3-bromo-N-(1-cyclohexylethyl)-4-methoxybenzamide
CID 62407763
4-(aminomethyl)-N-[(1S)-1-cycloheptylethyl]benzamide
CID 81392809
4-(bromomethyl)-N-[(1R)-1-cycloheptylethyl]benzamide
CID 102851926
N-(1-cyclohexylethyl)-2-fluoropyridine-4-carboxamide
CID 55069124
N-(1-cyclopentylethyl)-3-hydroxy-4-methoxybenzamide
CID 79672563
3-methoxy-N-(3-methylbutyl)-2-propylindazole-6-carboxamide
CID 71425614
3-ethoxy-N-(furan-2-ylmethyl)-2-propylindazole-6-carboxamide
CID 71425610
3-chloro-N-(1-cyclohexylethyl)-4-hydroxybenzamide
CID 62407060

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-cyclohexylethyl]-3-ethoxy-2-(2-methoxyethyl)indazole-6-carboxamide?
The IUPAC name of N-[(1R)-1-cyclohexylethyl]-3-ethoxy-2-(2-methoxyethyl)indazole-6-carboxamide (CID 11958403) is N-[(1R)-1-cyclohexylethyl]-3-ethoxy-2-(2-methoxyethyl)indazole-6-carboxamide.
What is the SMILES notation for N-[(1R)-1-cyclohexylethyl]-3-ethoxy-2-(2-methoxyethyl)indazole-6-carboxamide?
The canonical SMILES for N-[(1R)-1-cyclohexylethyl]-3-ethoxy-2-(2-methoxyethyl)indazole-6-carboxamide is CCOc1c2ccc(C(=O)N[C@H](C)C3CCCCC3)cc2nn1CCOC.
What is the InChIKey of N-[(1R)-1-cyclohexylethyl]-3-ethoxy-2-(2-methoxyethyl)indazole-6-carboxamide?
The InChIKey is ZWWSSORPFHFYDR-OAHLLOKOSA-N. The full InChI is InChI=1S/C21H31N3O3/c1-4-27-21-18-11-10-17(14-19(18)23-24(21)12-13-26-3)20(25)22-15(2)16-8-6-5-7-9-16/h10-11,14-16H,4-9,12-13H2,1-3H3,(H,22,25)/t15-/m1/s1.
What are the key properties of N-[(1R)-1-cyclohexylethyl]-3-ethoxy-2-(2-methoxyethyl)indazole-6-carboxamide?
N-[(1R)-1-cyclohexylethyl]-3-ethoxy-2-(2-methoxyethyl)indazole-6-carboxamide has a molecular weight of 373.50 g/mol, XLogP of 3.78, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-cyclohexylethyl]-3-ethoxy-2-(2-methoxyethyl)indazole-6-carboxamide is sourced from PubChem (CID 11958403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).