1-methyl-N-[(1-methylpiperidin-4-yl)methyl]-5-(1-methylpyrazol-4-yl)indazole-3-carboxamide

C20H26N6O — CID 153337270

IUPAC1-methyl-N-[(1-methylpiperidin-4-yl)methyl]-5-(1-methylpyrazol-4-yl)indazole-3-carboxamide
SMILESCN1CCC(CNC(=O)c2nn(C)c3ccc(-c4cnn(C)c4)cc23)CC1
InChIInChI=1S/C20H26N6O/c1-24-8-6-14(7-9-24)11-21-20(27)19-17-10-15(16-12-22-25(2)13-16)4-5-18(17)26(3)23-19/h4-5,10,12-14H,6-9,11H2,1-3H3,(H,21,27)
InChIKeyCKMUDIYNTXMOMP-UHFFFAOYSA-N
MW366.47 g/mol
LogP2.05
Rot. Bonds4

About 1-methyl-N-[(1-methylpiperidin-4-yl)methyl]-5-(1-methylpyrazol-4-yl)indazole-3-carboxamide

1-methyl-N-[(1-methylpiperidin-4-yl)methyl]-5-(1-methylpyrazol-4-yl)indazole-3-carboxamide (PubChem CID 153337270) has the molecular formula C20H26N6O and a molecular weight of 366.47 g/mol. Its IUPAC name is 1-methyl-N-[(1-methylpiperidin-4-yl)methyl]-5-(1-methylpyrazol-4-yl)indazole-3-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[(1-methylpiperidin-4-yl)methyl]-5-(1-methylpyrazol-4-yl)indazole-3-carboxamide
PubChem CID153337270
Molecular FormulaC20H26N6O
Molecular Weight366.47 g/mol
Exact Mass366.22
IUPAC Name1-methyl-N-[(1-methylpiperidin-4-yl)methyl]-5-(1-methylpyrazol-4-yl)indazole-3-carboxamide
SMILESCN1CCC(CNC(=O)c2nn(C)c3ccc(-c4cnn(C)c4)cc23)CC1
InChIInChI=1S/C20H26N6O/c1-24-8-6-14(7-9-24)11-21-20(27)19-17-10-15(16-12-22-25(2)13-16)4-5-18(17)26(3)23-19/h4-5,10,12-14H,6-9,11H2,1-3H3,(H,21,27)
InChIKeyCKMUDIYNTXMOMP-UHFFFAOYSA-N
XLogP2.05
TPSA67.98 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.47
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(4-chlorocyclohexyl)methyl]-1-methylindazole-3-carboxamide
CID 106133570
N-[[(3S)-1-ethylpiperidin-3-yl]methyl]-1,5-dimethylindazole-3-carboxamide
CID 95227494
1-methyl-N-[[1-(2-phenylethyl)piperidin-4-yl]methyl]indazole-3-carboxamide;hydrochloride
CID 71462661
3-methoxy-4-[[8-methyl-9-[4-(1-methylpyrazol-4-yl)phenyl]-5,6-dihydropyrazolo[3,4-h]quinazolin-2-yl]methyl]-N-[(1-methylpiperidin-4-yl)methyl]benzamide
CID 161156849
2-(1-methylpyrazol-4-yl)-N-[(1-propylpiperidin-4-yl)methyl]-1,3-thiazole-4-carboxamide
CID 51101862
5-(1-aminoisoquinolin-7-yl)-N-[(1-methylpiperidin-4-yl)methyl]-1H-indazole-3-carboxamide
CID 171446161
(1E)-3-[1-methyl-5-(1-methylpyrazol-4-yl)indazol-3-yl]-1-morpholin-4-ylbuta-1,3-dien-1-amine
CID 90400061
1-(2-aminoethyl)-N-[(1-methylpiperidin-4-yl)methyl]imidazole-4-carboxamide
CID 107498035
N-[(1-methylpiperidin-4-yl)methyl]-1H-indazole-3-carboxamide
CID 18695627
1,5-dimethyl-N-(2-pyrrolidin-1-ylethyl)indazole-3-carboxamide
CID 118788228
3,5-dihydroxy-N-[(1-methylpiperidin-4-yl)methyl]benzamide
CID 104938964
5-amino-N-[(1-methylpiperidin-4-yl)methyl]pyridine-2-carboxamide
CID 81316570

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[(1-methylpiperidin-4-yl)methyl]-5-(1-methylpyrazol-4-yl)indazole-3-carboxamide?
The IUPAC name of 1-methyl-N-[(1-methylpiperidin-4-yl)methyl]-5-(1-methylpyrazol-4-yl)indazole-3-carboxamide (CID 153337270) is 1-methyl-N-[(1-methylpiperidin-4-yl)methyl]-5-(1-methylpyrazol-4-yl)indazole-3-carboxamide.
What is the SMILES notation for 1-methyl-N-[(1-methylpiperidin-4-yl)methyl]-5-(1-methylpyrazol-4-yl)indazole-3-carboxamide?
The canonical SMILES for 1-methyl-N-[(1-methylpiperidin-4-yl)methyl]-5-(1-methylpyrazol-4-yl)indazole-3-carboxamide is CN1CCC(CNC(=O)c2nn(C)c3ccc(-c4cnn(C)c4)cc23)CC1.
What is the InChIKey of 1-methyl-N-[(1-methylpiperidin-4-yl)methyl]-5-(1-methylpyrazol-4-yl)indazole-3-carboxamide?
The InChIKey is CKMUDIYNTXMOMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N6O/c1-24-8-6-14(7-9-24)11-21-20(27)19-17-10-15(16-12-22-25(2)13-16)4-5-18(17)26(3)23-19/h4-5,10,12-14H,6-9,11H2,1-3H3,(H,21,27).
What are the key properties of 1-methyl-N-[(1-methylpiperidin-4-yl)methyl]-5-(1-methylpyrazol-4-yl)indazole-3-carboxamide?
1-methyl-N-[(1-methylpiperidin-4-yl)methyl]-5-(1-methylpyrazol-4-yl)indazole-3-carboxamide has a molecular weight of 366.47 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[(1-methylpiperidin-4-yl)methyl]-5-(1-methylpyrazol-4-yl)indazole-3-carboxamide is sourced from PubChem (CID 153337270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).