(4-propan-2-ylpiperazin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone

C15H24N4O — CID 53017432

IUPAC(4-propan-2-ylpiperazin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone
SMILESCC(C)N1CCN(C(=O)c2n[nH]c3c2CCCC3)CC1
InChIInChI=1S/C15H24N4O/c1-11(2)18-7-9-19(10-8-18)15(20)14-12-5-3-4-6-13(12)16-17-14/h11H,3-10H2,1-2H3,(H,16,17)
InChIKeyHQVPLFUNEUJTJG-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.45
Rot. Bonds2

About (4-propan-2-ylpiperazin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone

(4-propan-2-ylpiperazin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone (PubChem CID 53017432) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is (4-propan-2-ylpiperazin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone.

Molecular Properties

Compound Name(4-propan-2-ylpiperazin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone
PubChem CID53017432
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name(4-propan-2-ylpiperazin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone
SMILESCC(C)N1CCN(C(=O)c2n[nH]c3c2CCCC3)CC1
InChIInChI=1S/C15H24N4O/c1-11(2)18-7-9-19(10-8-18)15(20)14-12-5-3-4-6-13(12)16-17-14/h11H,3-10H2,1-2H3,(H,16,17)
InChIKeyHQVPLFUNEUJTJG-UHFFFAOYSA-N
XLogP1.45
TPSA52.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide
CID 2202791
N-(cyclopentylideneamino)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 820033
N-cyclohexyl-1,4,5,6,7,8-hexahydrocyclohepta[d]pyrazole-3-carboxamide
CID 25161455
5-(2-methylbutan-2-yl)-N-prop-2-enyl-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 25161459
5-(2-methylbutan-2-yl)-N-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 25161475
N-cyclopentyl-5-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 25163871
N-[2-(1-Cyclohexenyl)ethyl]-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 20887974
2,2,6,6-tetramethyl-4-(2-(4,5,6,7-tetrahydro-1H-indazole-3-carbonyl)hydrazono)piperidinium
CID 801131
5-(2-methylbutan-2-yl)-N-(2-morpholin-4-ylethyl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 25161456
N-(cyclopropylmethyl)-5-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 25161457
N-cyclohexyl-5-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 25161458
5-(2-methylbutan-2-yl)-N-propyl-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 25163410

Frequently Asked Questions

What is the IUPAC name of (4-propan-2-ylpiperazin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone?
The IUPAC name of (4-propan-2-ylpiperazin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone (CID 53017432) is (4-propan-2-ylpiperazin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone.
What is the SMILES notation for (4-propan-2-ylpiperazin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone?
The canonical SMILES for (4-propan-2-ylpiperazin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone is CC(C)N1CCN(C(=O)c2n[nH]c3c2CCCC3)CC1.
What is the InChIKey of (4-propan-2-ylpiperazin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone?
The InChIKey is HQVPLFUNEUJTJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-11(2)18-7-9-19(10-8-18)15(20)14-12-5-3-4-6-13(12)16-17-14/h11H,3-10H2,1-2H3,(H,16,17).
What are the key properties of (4-propan-2-ylpiperazin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone?
(4-propan-2-ylpiperazin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone has a molecular weight of 276.38 g/mol, XLogP of 1.45, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-propan-2-ylpiperazin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone is sourced from PubChem (CID 53017432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).