N-methyl-4-[(1-methylindazol-3-yl)methyl]piperidine-2-carboxamide

C16H22N4O — CID 106780087

IUPACN-methyl-4-[(1-methylindazol-3-yl)methyl]piperidine-2-carboxamide
SMILESCNC(=O)C1CC(Cc2nn(C)c3ccccc23)CCN1
InChIInChI=1S/C16H22N4O/c1-17-16(21)14-10-11(7-8-18-14)9-13-12-5-3-4-6-15(12)20(2)19-13/h3-6,11,14,18H,7-10H2,1-2H3,(H,17,21)
InChIKeyIQAGLWPIQLRLSC-UHFFFAOYSA-N
MW286.38 g/mol
LogP1.23
Rot. Bonds3

About N-methyl-4-[(1-methylindazol-3-yl)methyl]piperidine-2-carboxamide

N-methyl-4-[(1-methylindazol-3-yl)methyl]piperidine-2-carboxamide (PubChem CID 106780087) has the molecular formula C16H22N4O and a molecular weight of 286.38 g/mol. Its IUPAC name is N-methyl-4-[(1-methylindazol-3-yl)methyl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-4-[(1-methylindazol-3-yl)methyl]piperidine-2-carboxamide
PubChem CID106780087
Molecular FormulaC16H22N4O
Molecular Weight286.38 g/mol
Exact Mass286.18
IUPAC NameN-methyl-4-[(1-methylindazol-3-yl)methyl]piperidine-2-carboxamide
SMILESCNC(=O)C1CC(Cc2nn(C)c3ccccc23)CCN1
InChIInChI=1S/C16H22N4O/c1-17-16(21)14-10-11(7-8-18-14)9-13-12-5-3-4-6-15(12)20(2)19-13/h3-6,11,14,18H,7-10H2,1-2H3,(H,17,21)
InChIKeyIQAGLWPIQLRLSC-UHFFFAOYSA-N
XLogP1.23
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-3-(piperidin-4-ylmethyl)indazole
CID 84692872
3-(cyclopropylmethyl)-1-methylindazole
CID 142276732
N-methyl-4-[(1-propan-2-ylpyrazol-3-yl)methyl]piperidine-2-carboxamide
CID 106779584
3-(azepan-3-ylmethyl)-1-methylindazole
CID 104680728
4-[(4-tert-butylphenyl)methyl]-N-methylpiperidine-2-carboxamide
CID 106778581
4-(3,4-dihydro-2H-chromen-4-ylmethyl)-N-methylpiperidine-2-carboxamide
CID 106781123
6-[(1-methylindazol-3-yl)methyl]piperidine-2-carboxylic acid
CID 115930088
1-(1-methylindazol-3-yl)-3-pyrrolidin-2-ylpropan-2-one
CID 116560889
N-ethyl-4-[(2-fluorophenyl)methyl]piperidine-2-carboxamide
CID 106777776
N-methyl-N-[(1-methylindazol-3-yl)methyl]hydroxylamine
CID 82604100
1-(1-methylindazol-3-yl)-4-piperidin-2-ylbutan-2-one
CID 116563673
1-(1-methylindazol-3-yl)-3-(thian-4-yl)propan-2-one
CID 105111089

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[(1-methylindazol-3-yl)methyl]piperidine-2-carboxamide?
The IUPAC name of N-methyl-4-[(1-methylindazol-3-yl)methyl]piperidine-2-carboxamide (CID 106780087) is N-methyl-4-[(1-methylindazol-3-yl)methyl]piperidine-2-carboxamide.
What is the SMILES notation for N-methyl-4-[(1-methylindazol-3-yl)methyl]piperidine-2-carboxamide?
The canonical SMILES for N-methyl-4-[(1-methylindazol-3-yl)methyl]piperidine-2-carboxamide is CNC(=O)C1CC(Cc2nn(C)c3ccccc23)CCN1.
What is the InChIKey of N-methyl-4-[(1-methylindazol-3-yl)methyl]piperidine-2-carboxamide?
The InChIKey is IQAGLWPIQLRLSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O/c1-17-16(21)14-10-11(7-8-18-14)9-13-12-5-3-4-6-15(12)20(2)19-13/h3-6,11,14,18H,7-10H2,1-2H3,(H,17,21).
What are the key properties of N-methyl-4-[(1-methylindazol-3-yl)methyl]piperidine-2-carboxamide?
N-methyl-4-[(1-methylindazol-3-yl)methyl]piperidine-2-carboxamide has a molecular weight of 286.38 g/mol, XLogP of 1.23, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[(1-methylindazol-3-yl)methyl]piperidine-2-carboxamide is sourced from PubChem (CID 106780087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).