N-methyl-N-(pyrrolidin-2-ylmethyl)-1H-indazole-3-carboxamide

C14H18N4O — CID 106607449

IUPACN-methyl-N-(pyrrolidin-2-ylmethyl)-1H-indazole-3-carboxamide
SMILESCN(CC1CCCN1)C(=O)c1n[nH]c2ccccc12
InChIInChI=1S/C14H18N4O/c1-18(9-10-5-4-8-15-10)14(19)13-11-6-2-3-7-12(11)16-17-13/h2-3,6-7,10,15H,4-5,8-9H2,1H3,(H,16,17)
InChIKeyHBIIFYJHQJHIDB-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.39
Rot. Bonds3

About N-methyl-N-(pyrrolidin-2-ylmethyl)-1H-indazole-3-carboxamide

N-methyl-N-(pyrrolidin-2-ylmethyl)-1H-indazole-3-carboxamide (PubChem CID 106607449) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is N-methyl-N-(pyrrolidin-2-ylmethyl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(pyrrolidin-2-ylmethyl)-1H-indazole-3-carboxamide
PubChem CID106607449
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC NameN-methyl-N-(pyrrolidin-2-ylmethyl)-1H-indazole-3-carboxamide
SMILESCN(CC1CCCN1)C(=O)c1n[nH]c2ccccc12
InChIInChI=1S/C14H18N4O/c1-18(9-10-5-4-8-15-10)14(19)13-11-6-2-3-7-12(11)16-17-13/h2-3,6-7,10,15H,4-5,8-9H2,1H3,(H,16,17)
InChIKeyHBIIFYJHQJHIDB-UHFFFAOYSA-N
XLogP1.39
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-N-(pyrrolidin-2-ylmethyl)-1H-indazole-3-carboxamide
CID 104974145
N-(2-hydroxyethyl)-N-(pyrrolidin-2-ylmethyl)-1H-indazole-3-carboxamide
CID 106612562
N-methyl-N-(oxan-4-ylmethyl)-1H-indazole-3-carboxamide
CID 64982701
2-hydroxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106608014
2-ethyl-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106607295
N-methyl-N-(2-pyrrolidin-1-ylethyl)-1H-indazole-3-carboxamide
CID 63239690
N,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-2-carboxamide
CID 106607724
5-amino-N-(cyclopentylmethyl)-N-methyl-1H-indazole-3-carboxamide
CID 63632080
N-ethyl-N-piperidin-4-yl-1H-indazole-3-carboxamide
CID 60805904
N-methyl-N-(2-piperazin-1-ylethyl)-1H-indazole-3-carboxamide
CID 63265749
N-(2-cyanoethyl)-N-methyl-1H-indazole-3-carboxamide
CID 60655163
N-methyl-N-(pyrrolidin-2-ylmethyl)-1,2-oxazole-3-carboxamide
CID 106607345

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(pyrrolidin-2-ylmethyl)-1H-indazole-3-carboxamide?
The IUPAC name of N-methyl-N-(pyrrolidin-2-ylmethyl)-1H-indazole-3-carboxamide (CID 106607449) is N-methyl-N-(pyrrolidin-2-ylmethyl)-1H-indazole-3-carboxamide.
What is the SMILES notation for N-methyl-N-(pyrrolidin-2-ylmethyl)-1H-indazole-3-carboxamide?
The canonical SMILES for N-methyl-N-(pyrrolidin-2-ylmethyl)-1H-indazole-3-carboxamide is CN(CC1CCCN1)C(=O)c1n[nH]c2ccccc12.
What is the InChIKey of N-methyl-N-(pyrrolidin-2-ylmethyl)-1H-indazole-3-carboxamide?
The InChIKey is HBIIFYJHQJHIDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-18(9-10-5-4-8-15-10)14(19)13-11-6-2-3-7-12(11)16-17-13/h2-3,6-7,10,15H,4-5,8-9H2,1H3,(H,16,17).
What are the key properties of N-methyl-N-(pyrrolidin-2-ylmethyl)-1H-indazole-3-carboxamide?
N-methyl-N-(pyrrolidin-2-ylmethyl)-1H-indazole-3-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 1.39, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(pyrrolidin-2-ylmethyl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 106607449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).