1-cyclobutyl-5-[5-[(dimethylamino)methyl]-3-pyridinyl]indazole-3-carboxamide

C20H23N5O — CID 174835336

IUPAC1-cyclobutyl-5-[5-[(dimethylamino)methyl]-3-pyridinyl]indazole-3-carboxamide
SMILESCN(C)Cc1cncc(-c2ccc3c(c2)c(C(N)=O)nn3C2CCC2)c1
InChIInChI=1S/C20H23N5O/c1-24(2)12-13-8-15(11-22-10-13)14-6-7-18-17(9-14)19(20(21)26)23-25(18)16-4-3-5-16/h6-11,16H,3-5,12H2,1-2H3,(H2,21,26)
InChIKeyWIEGSTFKYXWYGH-UHFFFAOYSA-N
MW349.44 g/mol
LogP2.98
Rot. Bonds5

About 1-cyclobutyl-5-[5-[(dimethylamino)methyl]-3-pyridinyl]indazole-3-carboxamide

1-cyclobutyl-5-[5-[(dimethylamino)methyl]-3-pyridinyl]indazole-3-carboxamide (PubChem CID 174835336) has the molecular formula C20H23N5O and a molecular weight of 349.44 g/mol. Its IUPAC name is 1-cyclobutyl-5-[5-[(dimethylamino)methyl]-3-pyridinyl]indazole-3-carboxamide.

Molecular Properties

Compound Name1-cyclobutyl-5-[5-[(dimethylamino)methyl]-3-pyridinyl]indazole-3-carboxamide
PubChem CID174835336
Molecular FormulaC20H23N5O
Molecular Weight349.44 g/mol
Exact Mass349.19
IUPAC Name1-cyclobutyl-5-[5-[(dimethylamino)methyl]-3-pyridinyl]indazole-3-carboxamide
SMILESCN(C)Cc1cncc(-c2ccc3c(c2)c(C(N)=O)nn3C2CCC2)c1
InChIInChI=1S/C20H23N5O/c1-24(2)12-13-8-15(11-22-10-13)14-6-7-18-17(9-14)19(20(21)26)23-25(18)16-4-3-5-16/h6-11,16H,3-5,12H2,1-2H3,(H2,21,26)
InChIKeyWIEGSTFKYXWYGH-UHFFFAOYSA-N
XLogP2.98
TPSA77.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.44
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-cyclohexyl-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]indazole-3-carboxamide
CID 175327408
1-cyclopropyl-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]indazole-3-carboxamide
CID 118383862
1-[4-(dimethylamino)cyclohexyl]-5-pyridin-3-ylindazole-3-carboxamide
CID 140689312
1-cyclopropyl-5-(2-methylpyrimidin-5-yl)indazole-3-carboxamide
CID 162459699
N-cyclohexyl-5-[5-[(dimethylamino)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118382113
tert-butyl 4-[3-carbamoyl-5-(2-fluoro-4-pyridinyl)indazol-1-yl]piperidine-1-carboxylate
CID 175283411
N-(2,3-dihydro-1H-inden-2-yl)-5-[5-[(dimethylamino)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118381150
5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118381235
1-piperidin-4-yl-5-[(E)-2-piperidin-4-ylethenyl]indazole-3-carboxamide
CID 173251238
5-[5-[(dimethylamino)methyl]-3-pyridinyl]-N-[6-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 89450996
N-[1-[5-[5-[(dimethylamino)methyl]-3-pyridinyl]-1H-indazol-3-yl]ethenyl]-1-propan-2-ylpiperidin-4-amine
CID 144928900
N-cyclopropyl-5-[5-(diethylaminomethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118381625

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-5-[5-[(dimethylamino)methyl]-3-pyridinyl]indazole-3-carboxamide?
The IUPAC name of 1-cyclobutyl-5-[5-[(dimethylamino)methyl]-3-pyridinyl]indazole-3-carboxamide (CID 174835336) is 1-cyclobutyl-5-[5-[(dimethylamino)methyl]-3-pyridinyl]indazole-3-carboxamide.
What is the SMILES notation for 1-cyclobutyl-5-[5-[(dimethylamino)methyl]-3-pyridinyl]indazole-3-carboxamide?
The canonical SMILES for 1-cyclobutyl-5-[5-[(dimethylamino)methyl]-3-pyridinyl]indazole-3-carboxamide is CN(C)Cc1cncc(-c2ccc3c(c2)c(C(N)=O)nn3C2CCC2)c1.
What is the InChIKey of 1-cyclobutyl-5-[5-[(dimethylamino)methyl]-3-pyridinyl]indazole-3-carboxamide?
The InChIKey is WIEGSTFKYXWYGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O/c1-24(2)12-13-8-15(11-22-10-13)14-6-7-18-17(9-14)19(20(21)26)23-25(18)16-4-3-5-16/h6-11,16H,3-5,12H2,1-2H3,(H2,21,26).
What are the key properties of 1-cyclobutyl-5-[5-[(dimethylamino)methyl]-3-pyridinyl]indazole-3-carboxamide?
1-cyclobutyl-5-[5-[(dimethylamino)methyl]-3-pyridinyl]indazole-3-carboxamide has a molecular weight of 349.44 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-5-[5-[(dimethylamino)methyl]-3-pyridinyl]indazole-3-carboxamide is sourced from PubChem (CID 174835336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).