N-ethyl-N-(2-hydroxy-2-methylpropyl)-1-methylindazole-3-carboxamide

C15H21N3O2 — CID 103120277

IUPACN-ethyl-N-(2-hydroxy-2-methylpropyl)-1-methylindazole-3-carboxamide
SMILESCCN(CC(C)(C)O)C(=O)c1nn(C)c2ccccc12
InChIInChI=1S/C15H21N3O2/c1-5-18(10-15(2,3)20)14(19)13-11-8-6-7-9-12(11)17(4)16-13/h6-9,20H,5,10H2,1-4H3
InChIKeyARMQYTPFHNWGSU-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.81
Rot. Bonds4

About N-ethyl-N-(2-hydroxy-2-methylpropyl)-1-methylindazole-3-carboxamide

N-ethyl-N-(2-hydroxy-2-methylpropyl)-1-methylindazole-3-carboxamide (PubChem CID 103120277) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is N-ethyl-N-(2-hydroxy-2-methylpropyl)-1-methylindazole-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(2-hydroxy-2-methylpropyl)-1-methylindazole-3-carboxamide
PubChem CID103120277
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC NameN-ethyl-N-(2-hydroxy-2-methylpropyl)-1-methylindazole-3-carboxamide
SMILESCCN(CC(C)(C)O)C(=O)c1nn(C)c2ccccc12
InChIInChI=1S/C15H21N3O2/c1-5-18(10-15(2,3)20)14(19)13-11-8-6-7-9-12(11)17(4)16-13/h6-9,20H,5,10H2,1-4H3
InChIKeyARMQYTPFHNWGSU-UHFFFAOYSA-N
XLogP1.81
TPSA58.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(1-methylindazole-3-carbonyl)-propylamino]acetic acid
CID 103116595
N-ethyl-N-(2-hydroxy-2-methylpropyl)-4-oxo-3H-phthalazine-1-carboxamide
CID 79377425
N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide
CID 111596732
N,1-dimethyl-N-phenylindazole-3-carboxamide
CID 110856917
N-benzyl-N,1-dimethylindazole-3-carboxamide
CID 110851100
N-(2-bromoethyl)-N-(2-methoxyethyl)-1-methylindazole-3-carboxamide
CID 103122845
N-(2-bromoethyl)-N-(2,2-difluoroethyl)-1-methylindazole-3-carboxamide
CID 107491860
2-[(1-methylindazole-3-carbonyl)-propan-2-ylamino]acetic acid
CID 103116549
N-(3-chloro-2,2-dimethylpropyl)-1-methylindazole-3-carboxamide
CID 103122780
N-(2-chloropropyl)-1-methylindazole-3-carboxamide
CID 103122559
N,1-dimethyl-N-[2-(methylamino)ethyl]indazole-3-carboxamide
CID 103117269
N-ethyl-N-(2-hydroxy-2-methylpropyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103721379

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-hydroxy-2-methylpropyl)-1-methylindazole-3-carboxamide?
The IUPAC name of N-ethyl-N-(2-hydroxy-2-methylpropyl)-1-methylindazole-3-carboxamide (CID 103120277) is N-ethyl-N-(2-hydroxy-2-methylpropyl)-1-methylindazole-3-carboxamide.
What is the SMILES notation for N-ethyl-N-(2-hydroxy-2-methylpropyl)-1-methylindazole-3-carboxamide?
The canonical SMILES for N-ethyl-N-(2-hydroxy-2-methylpropyl)-1-methylindazole-3-carboxamide is CCN(CC(C)(C)O)C(=O)c1nn(C)c2ccccc12.
What is the InChIKey of N-ethyl-N-(2-hydroxy-2-methylpropyl)-1-methylindazole-3-carboxamide?
The InChIKey is ARMQYTPFHNWGSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-5-18(10-15(2,3)20)14(19)13-11-8-6-7-9-12(11)17(4)16-13/h6-9,20H,5,10H2,1-4H3.
What are the key properties of N-ethyl-N-(2-hydroxy-2-methylpropyl)-1-methylindazole-3-carboxamide?
N-ethyl-N-(2-hydroxy-2-methylpropyl)-1-methylindazole-3-carboxamide has a molecular weight of 275.35 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-hydroxy-2-methylpropyl)-1-methylindazole-3-carboxamide is sourced from PubChem (CID 103120277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).