(2R)-2-amino-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)propanamide;hydrochloride

C13H23ClN4O — CID 119325314

IUPAC(2R)-2-amino-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)propanamide;hydrochloride
SMILESCC(C)n1cc2c(n1)CC(NC(=O)[C@@H](C)N)CC2.Cl
InChIInChI=1S/C13H22N4O.ClH/c1-8(2)17-7-10-4-5-11(6-12(10)16-17)15-13(18)9(3)14;/h7-9,11H,4-6,14H2,1-3H3,(H,15,18);1H/t9-,11?;/m1./s1
InChIKeyHDOIFZXQJMZSAR-INDIWFAOSA-N
MW286.81 g/mol
LogP1.21
Rot. Bonds3

About (2R)-2-amino-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)propanamide;hydrochloride

(2R)-2-amino-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)propanamide;hydrochloride (PubChem CID 119325314) has the molecular formula C13H23ClN4O and a molecular weight of 286.81 g/mol. Its IUPAC name is (2R)-2-amino-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)propanamide;hydrochloride.

Molecular Properties

Compound Name(2R)-2-amino-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)propanamide;hydrochloride
PubChem CID119325314
Molecular FormulaC13H23ClN4O
Molecular Weight286.81 g/mol
Exact Mass286.16
IUPAC Name(2R)-2-amino-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)propanamide;hydrochloride
SMILESCC(C)n1cc2c(n1)CC(NC(=O)[C@@H](C)N)CC2.Cl
InChIInChI=1S/C13H22N4O.ClH/c1-8(2)17-7-10-4-5-11(6-12(10)16-17)15-13(18)9(3)14;/h7-9,11H,4-6,14H2,1-3H3,(H,15,18);1H/t9-,11?;/m1./s1
InChIKeyHDOIFZXQJMZSAR-INDIWFAOSA-N
XLogP1.21
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.81
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (2R)-2-amino-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)propanamide;hydrochloride with MolForge

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Related Compounds

2-(dimethylamino)-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)benzamide
CID 154778939
(2R)-2-amino-N-(1,2,3,4-tetrahydronaphthalen-2-yl)propanamide;hydrochloride
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N-[(6S)-2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl]thieno[2,3-b]pyridine-2-carboxamide
CID 164639566
2-propan-2-yl-4,5,6,7-tetrahydroindazole-6-carbonitrile
CID 84719337
2-propan-2-yl-4,5,6,7-tetrahydroindazole-5-carboxylic acid
CID 83863210
2-amino-N-(2,3-dihydro-1H-inden-2-yl)propanamide
CID 14599683
2-amino-2-(1-methylpyrazol-4-yl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide
CID 115290593
(2R)-2-amino-N-(thian-4-yl)propanamide
CID 103796198
(2R)-2-amino-N-cyclopent-3-en-1-ylpropanamide
CID 104863900
(2R)-2-amino-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide;hydrochloride
CID 120873780
(2R)-2-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide;dihydrochloride
CID 119857933
2-amino-3-methoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)propanamide
CID 81089612

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)propanamide;hydrochloride?
The IUPAC name of (2R)-2-amino-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)propanamide;hydrochloride (CID 119325314) is (2R)-2-amino-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)propanamide;hydrochloride.
What is the SMILES notation for (2R)-2-amino-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)propanamide;hydrochloride?
The canonical SMILES for (2R)-2-amino-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)propanamide;hydrochloride is CC(C)n1cc2c(n1)CC(NC(=O)[C@@H](C)N)CC2.Cl.
What is the InChIKey of (2R)-2-amino-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)propanamide;hydrochloride?
The InChIKey is HDOIFZXQJMZSAR-INDIWFAOSA-N. The full InChI is InChI=1S/C13H22N4O.ClH/c1-8(2)17-7-10-4-5-11(6-12(10)16-17)15-13(18)9(3)14;/h7-9,11H,4-6,14H2,1-3H3,(H,15,18);1H/t9-,11?;/m1./s1.
What are the key properties of (2R)-2-amino-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)propanamide;hydrochloride?
(2R)-2-amino-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)propanamide;hydrochloride has a molecular weight of 286.81 g/mol, XLogP of 1.21, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)propanamide;hydrochloride is sourced from PubChem (CID 119325314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).