N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride

C14H23ClN4O — CID 119730423

IUPACN-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride
SMILESCl.Cn1ncc2c1CCCC2NC(=O)CC1CCCN1
InChIInChI=1S/C14H22N4O.ClH/c1-18-13-6-2-5-12(11(13)9-16-18)17-14(19)8-10-4-3-7-15-10;/h9-10,12,15H,2-8H2,1H3,(H,17,19);1H
InChIKeyQVMZRMRWRUQAOM-UHFFFAOYSA-N
MW298.82 g/mol
LogP1.48
Rot. Bonds3

About N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride

N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride (PubChem CID 119730423) has the molecular formula C14H23ClN4O and a molecular weight of 298.82 g/mol. Its IUPAC name is N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride
PubChem CID119730423
Molecular FormulaC14H23ClN4O
Molecular Weight298.82 g/mol
Exact Mass298.16
IUPAC NameN-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride
SMILESCl.Cn1ncc2c1CCCC2NC(=O)CC1CCCN1
InChIInChI=1S/C14H22N4O.ClH/c1-18-13-6-2-5-12(11(13)9-16-18)17-14(19)8-10-4-3-7-15-10;/h9-10,12,15H,2-8H2,1H3,(H,17,19);1H
InChIKeyQVMZRMRWRUQAOM-UHFFFAOYSA-N
XLogP1.48
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.82
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-2-piperidin-4-ylacetamide;hydrochloride
CID 119730410
1-methyl-N-(1-pyrrolidin-2-ylpropan-2-yl)-4,5,6,7-tetrahydroindazol-4-amine
CID 79541855
2-cyclopentyloxy-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide
CID 71939980
3-amino-3-methyl-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)butanamide
CID 64683649
2-cyano-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)acetamide
CID 110470107
2-[2-[(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)amino]-2-oxoethyl]sulfanylacetic acid
CID 104569374
4-(methylamino)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)butanamide
CID 54925355
N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)cyclopropanecarboxamide
CID 42958313
6-amino-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)hexanamide
CID 43712066
4-(methoxymethyl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-4-carboxamide;hydrochloride
CID 120623245
(2R)-2-amino-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)propanamide;hydrochloride
CID 119293132
N-(1,5-dimethylpyrazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119797911

Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride?
The IUPAC name of N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride (CID 119730423) is N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride.
What is the SMILES notation for N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride?
The canonical SMILES for N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride is Cl.Cn1ncc2c1CCCC2NC(=O)CC1CCCN1.
What is the InChIKey of N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride?
The InChIKey is QVMZRMRWRUQAOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O.ClH/c1-18-13-6-2-5-12(11(13)9-16-18)17-14(19)8-10-4-3-7-15-10;/h9-10,12,15H,2-8H2,1H3,(H,17,19);1H.
What are the key properties of N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride?
N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride has a molecular weight of 298.82 g/mol, XLogP of 1.48, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride is sourced from PubChem (CID 119730423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).