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

C15H20N4O — CID 63239690

IUPACN-methyl-N-(2-pyrrolidin-1-ylethyl)-1H-indazole-3-carboxamide
SMILESCN(CCN1CCCC1)C(=O)c1n[nH]c2ccccc12
InChIInChI=1S/C15H20N4O/c1-18(10-11-19-8-4-5-9-19)15(20)14-12-6-2-3-7-13(12)16-17-14/h2-3,6-7H,4-5,8-11H2,1H3,(H,16,17)
InChIKeyIPRNWMXQTDNTOO-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.73
Rot. Bonds4

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

N-methyl-N-(2-pyrrolidin-1-ylethyl)-1H-indazole-3-carboxamide (PubChem CID 63239690) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is N-methyl-N-(2-pyrrolidin-1-ylethyl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(2-pyrrolidin-1-ylethyl)-1H-indazole-3-carboxamide
PubChem CID63239690
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC NameN-methyl-N-(2-pyrrolidin-1-ylethyl)-1H-indazole-3-carboxamide
SMILESCN(CCN1CCCC1)C(=O)c1n[nH]c2ccccc12
InChIInChI=1S/C15H20N4O/c1-18(10-11-19-8-4-5-9-19)15(20)14-12-6-2-3-7-13(12)16-17-14/h2-3,6-7H,4-5,8-11H2,1H3,(H,16,17)
InChIKeyIPRNWMXQTDNTOO-UHFFFAOYSA-N
XLogP1.73
TPSA52.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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-(3-amino-4-methylpentyl)-N-methyl-1H-indazole-3-carboxamide
CID 81484244
N-[(2-chlorophenyl)methyl]-N-methyl-1H-indazole-3-carboxamide
CID 7537965
N-methyl-N-(pyrrolidin-2-ylmethyl)-1H-indazole-3-carboxamide
CID 106607449
4-amino-N-methyl-5-propan-2-yl-N-(2-pyrrolidin-1-ylethyl)-1H-pyrazole-3-carboxamide
CID 63207158
N-[2-(4-fluorophenoxy)ethyl]-N-methyl-1H-indazole-3-carboxamide
CID 18119662
N-methyl-N-(2-methylbutyl)-1H-indazole-3-carboxamide
CID 63932230
N-[(4-fluorophenyl)methyl]-N-methyl-1H-indazole-3-carboxamide
CID 51162817
3-[1H-indazole-3-carbonyl(methyl)amino]-2-methylpropanoic acid
CID 55008009
2-(1H-indol-3-yl)-N-methyl-N-(2-pyrrolidin-1-ylethyl)acetamide
CID 63208732
N-[(1-methylpiperidin-4-yl)methyl]-1H-indazole-3-carboxamide
CID 18695627

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-pyrrolidin-1-ylethyl)-1H-indazole-3-carboxamide?
The IUPAC name of N-methyl-N-(2-pyrrolidin-1-ylethyl)-1H-indazole-3-carboxamide (CID 63239690) is N-methyl-N-(2-pyrrolidin-1-ylethyl)-1H-indazole-3-carboxamide.
What is the SMILES notation for N-methyl-N-(2-pyrrolidin-1-ylethyl)-1H-indazole-3-carboxamide?
The canonical SMILES for N-methyl-N-(2-pyrrolidin-1-ylethyl)-1H-indazole-3-carboxamide is CN(CCN1CCCC1)C(=O)c1n[nH]c2ccccc12.
What is the InChIKey of N-methyl-N-(2-pyrrolidin-1-ylethyl)-1H-indazole-3-carboxamide?
The InChIKey is IPRNWMXQTDNTOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-18(10-11-19-8-4-5-9-19)15(20)14-12-6-2-3-7-13(12)16-17-14/h2-3,6-7H,4-5,8-11H2,1H3,(H,16,17).
What are the key properties of N-methyl-N-(2-pyrrolidin-1-ylethyl)-1H-indazole-3-carboxamide?
N-methyl-N-(2-pyrrolidin-1-ylethyl)-1H-indazole-3-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 1.73, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-pyrrolidin-1-ylethyl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 63239690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).