3-indazol-2-yl-N-(4-methoxy-2,6-dimethyl-3-pyridinyl)pyrrolidine-1-carboxamide

C20H23N5O2 — CID 166281172

IUPAC3-indazol-2-yl-N-(4-methoxy-2,6-dimethyl-3-pyridinyl)pyrrolidine-1-carboxamide
SMILESCOc1cc(C)nc(C)c1NC(=O)N1CCC(n2cc3ccccc3n2)C1
InChIInChI=1S/C20H23N5O2/c1-13-10-18(27-3)19(14(2)21-13)22-20(26)24-9-8-16(12-24)25-11-15-6-4-5-7-17(15)23-25/h4-7,10-11,16H,8-9,12H2,1-3H3,(H,22,26)
InChIKeyYBVLCQWLBJTWOI-UHFFFAOYSA-N
MW365.44 g/mol
LogP3.54
Rot. Bonds3

About 3-indazol-2-yl-N-(4-methoxy-2,6-dimethyl-3-pyridinyl)pyrrolidine-1-carboxamide

3-indazol-2-yl-N-(4-methoxy-2,6-dimethyl-3-pyridinyl)pyrrolidine-1-carboxamide (PubChem CID 166281172) has the molecular formula C20H23N5O2 and a molecular weight of 365.44 g/mol. Its IUPAC name is 3-indazol-2-yl-N-(4-methoxy-2,6-dimethyl-3-pyridinyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name3-indazol-2-yl-N-(4-methoxy-2,6-dimethyl-3-pyridinyl)pyrrolidine-1-carboxamide
PubChem CID166281172
Molecular FormulaC20H23N5O2
Molecular Weight365.44 g/mol
Exact Mass365.19
IUPAC Name3-indazol-2-yl-N-(4-methoxy-2,6-dimethyl-3-pyridinyl)pyrrolidine-1-carboxamide
SMILESCOc1cc(C)nc(C)c1NC(=O)N1CCC(n2cc3ccccc3n2)C1
InChIInChI=1S/C20H23N5O2/c1-13-10-18(27-3)19(14(2)21-13)22-20(26)24-9-8-16(12-24)25-11-15-6-4-5-7-17(15)23-25/h4-7,10-11,16H,8-9,12H2,1-3H3,(H,22,26)
InChIKeyYBVLCQWLBJTWOI-UHFFFAOYSA-N
XLogP3.54
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.44
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(3-indazol-2-ylpyrrolidin-1-yl)-2-oxoethyl]benzamide
CID 154754431
1-[4-[5-(2-fluoro-6-methoxyphenyl)indazol-2-yl]piperidin-1-yl]prop-2-en-1-one
CID 155667197
N-(2-methoxyphenyl)-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]piperidine-1-carboxamide
CID 166595317
tert-butyl 4-[2-[4-[6-methoxy-5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]piperidin-1-yl]ethyl]piperazine-1-carboxylate
CID 170051548
tert-butyl 4-[3-[4-[6-methoxy-5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]piperidin-1-yl]propyl]piperidine-1-carboxylate
CID 170051499
N-(2-cyclohexyl-6-methoxyindazol-5-yl)-2,3-difluorobenzamide;ethane
CID 155751873
N-[2-(4-cyano-4-methylcyclohexyl)-6-methoxyindazol-5-yl]-6-methylpyridine-2-carboxamide
CID 175253804
N-(2-methylquinolin-4-yl)azepane-1-carboxamide
CID 115882563
1-N-(2-methoxy-6-methylphenyl)piperidine-1,3-dicarboxamide
CID 119053091
1-[(3-methoxy-6-methyl-2-pyridinyl)carbamoyl]piperidine-4-carboxylic acid
CID 122090037
2-fluoro-N-[6-methoxy-2-(4-propan-2-ylcyclohexyl)indazol-5-yl]benzamide
CID 167156352
(3S)-N-(2-fluoro-6-methoxyphenyl)-3-(piperidin-1-ylmethyl)pyrrolidine-1-carboxamide
CID 99826576

Frequently Asked Questions

What is the IUPAC name of 3-indazol-2-yl-N-(4-methoxy-2,6-dimethyl-3-pyridinyl)pyrrolidine-1-carboxamide?
The IUPAC name of 3-indazol-2-yl-N-(4-methoxy-2,6-dimethyl-3-pyridinyl)pyrrolidine-1-carboxamide (CID 166281172) is 3-indazol-2-yl-N-(4-methoxy-2,6-dimethyl-3-pyridinyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for 3-indazol-2-yl-N-(4-methoxy-2,6-dimethyl-3-pyridinyl)pyrrolidine-1-carboxamide?
The canonical SMILES for 3-indazol-2-yl-N-(4-methoxy-2,6-dimethyl-3-pyridinyl)pyrrolidine-1-carboxamide is COc1cc(C)nc(C)c1NC(=O)N1CCC(n2cc3ccccc3n2)C1.
What is the InChIKey of 3-indazol-2-yl-N-(4-methoxy-2,6-dimethyl-3-pyridinyl)pyrrolidine-1-carboxamide?
The InChIKey is YBVLCQWLBJTWOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O2/c1-13-10-18(27-3)19(14(2)21-13)22-20(26)24-9-8-16(12-24)25-11-15-6-4-5-7-17(15)23-25/h4-7,10-11,16H,8-9,12H2,1-3H3,(H,22,26).
What are the key properties of 3-indazol-2-yl-N-(4-methoxy-2,6-dimethyl-3-pyridinyl)pyrrolidine-1-carboxamide?
3-indazol-2-yl-N-(4-methoxy-2,6-dimethyl-3-pyridinyl)pyrrolidine-1-carboxamide has a molecular weight of 365.44 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-indazol-2-yl-N-(4-methoxy-2,6-dimethyl-3-pyridinyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 166281172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).