4-amino-N-(2-methyl-1H-indol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide

C17H19N5O — CID 166306049

IUPAC4-amino-N-(2-methyl-1H-indol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide
SMILESCc1[nH]c2ccccc2c1NC(=O)c1cc2n(n1)CCCC2N
InChIInChI=1S/C17H19N5O/c1-10-16(11-5-2-3-7-13(11)19-10)20-17(23)14-9-15-12(18)6-4-8-22(15)21-14/h2-3,5,7,9,12,19H,4,6,8,18H2,1H3,(H,20,23)
InChIKeyHWFXXQBTXYTFTB-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.72
Rot. Bonds2

About 4-amino-N-(2-methyl-1H-indol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide

4-amino-N-(2-methyl-1H-indol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide (PubChem CID 166306049) has the molecular formula C17H19N5O and a molecular weight of 309.37 g/mol. Its IUPAC name is 4-amino-N-(2-methyl-1H-indol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-methyl-1H-indol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide
PubChem CID166306049
Molecular FormulaC17H19N5O
Molecular Weight309.37 g/mol
Exact Mass309.16
IUPAC Name4-amino-N-(2-methyl-1H-indol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide
SMILESCc1[nH]c2ccccc2c1NC(=O)c1cc2n(n1)CCCC2N
InChIInChI=1S/C17H19N5O/c1-10-16(11-5-2-3-7-13(11)19-10)20-17(23)14-9-15-12(18)6-4-8-22(15)21-14/h2-3,5,7,9,12,19H,4,6,8,18H2,1H3,(H,20,23)
InChIKeyHWFXXQBTXYTFTB-UHFFFAOYSA-N
XLogP2.72
TPSA88.73 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(2-methyl-1H-indol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide;2,2,2-trifluoroacetic acid
CID 166306048
4-amino-N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide
CID 155955429
5-bromo-N-(2-methyl-1H-indol-3-yl)pyrazine-2-carboxamide
CID 112527061
5-chloro-N-(2-methyl-1H-indol-3-yl)thiophene-2-carboxamide
CID 112527047
4-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxylic acid
CID 142375283
N-(cyclopropylmethyl)-2-methyl-1H-indole-3-carboxamide
CID 34829550
(2R)-1-(2-methyl-1H-indole-3-carbonyl)pyrrolidine-2-carboxylic acid
CID 78922406
4-amino-N-(2H-benzotriazol-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide
CID 166361874
3,3-dimethyl-N-(2-methyl-1H-indol-3-yl)butanamide
CID 146109310
2-(4-aminotriazol-1-yl)-N-(2-methyl-1H-indol-3-yl)acetamide
CID 112527109
2-(aminomethyl)-N-(2-methyl-1H-indol-3-yl)butanamide
CID 115186828
4-(2-aminopyrrolidin-1-yl)-2-oxo-1H-quinoline-3-carboxylic acid
CID 67917706

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-methyl-1H-indol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide?
The IUPAC name of 4-amino-N-(2-methyl-1H-indol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide (CID 166306049) is 4-amino-N-(2-methyl-1H-indol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide.
What is the SMILES notation for 4-amino-N-(2-methyl-1H-indol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide?
The canonical SMILES for 4-amino-N-(2-methyl-1H-indol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide is Cc1[nH]c2ccccc2c1NC(=O)c1cc2n(n1)CCCC2N.
What is the InChIKey of 4-amino-N-(2-methyl-1H-indol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide?
The InChIKey is HWFXXQBTXYTFTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O/c1-10-16(11-5-2-3-7-13(11)19-10)20-17(23)14-9-15-12(18)6-4-8-22(15)21-14/h2-3,5,7,9,12,19H,4,6,8,18H2,1H3,(H,20,23).
What are the key properties of 4-amino-N-(2-methyl-1H-indol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide?
4-amino-N-(2-methyl-1H-indol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide has a molecular weight of 309.37 g/mol, XLogP of 2.72, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-methyl-1H-indol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide is sourced from PubChem (CID 166306049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).