N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide

C18H24N6O2 — CID 171492021

IUPACN-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
SMILESCc1ccc(NC(=O)c2cc3n(n2)CCCO3)nc1N1CCN(C)CC1
InChIInChI=1S/C18H24N6O2/c1-13-4-5-15(19-17(13)23-9-7-22(2)8-10-23)20-18(25)14-12-16-24(21-14)6-3-11-26-16/h4-5,12H,3,6-11H2,1-2H3,(H,19,20,25)
InChIKeyCLKMHIHIEHPSAR-UHFFFAOYSA-N
MW356.43 g/mol
LogP1.37
Rot. Bonds3

About N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide

N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide (PubChem CID 171492021) has the molecular formula C18H24N6O2 and a molecular weight of 356.43 g/mol. Its IUPAC name is N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide.

Molecular Properties

Compound NameN-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
PubChem CID171492021
Molecular FormulaC18H24N6O2
Molecular Weight356.43 g/mol
Exact Mass356.20
IUPAC NameN-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
SMILESCc1ccc(NC(=O)c2cc3n(n2)CCCO3)nc1N1CCN(C)CC1
InChIInChI=1S/C18H24N6O2/c1-13-4-5-15(19-17(13)23-9-7-22(2)8-10-23)20-18(25)14-12-16-24(21-14)6-3-11-26-16/h4-5,12H,3,6-11H2,1-2H3,(H,19,20,25)
InChIKeyCLKMHIHIEHPSAR-UHFFFAOYSA-N
XLogP1.37
TPSA75.52 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,4,6-trimethylphenyl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
CID 90536897
N-(2-methyl-5-nitrophenyl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
CID 90536892
1-methyl-N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]indazole-5-carboxamide
CID 171491963
N-(2-carbamoylphenyl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
CID 71789320
N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxamide
CID 171492031
N-(1,3,3,7-tetramethyl-2-oxoindol-5-yl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
CID 91959306
N-(2-methylsulfanylphenyl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
CID 71789317
N-quinolin-8-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
CID 71789372
N-(3,3-diphenylpropyl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
CID 90536811
1-(2-chlorophenyl)-3-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]urea
CID 171491859
N-(1-benzylpyrazol-3-yl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
CID 91959265
N-(1-phenylethyl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
CID 90536800

Frequently Asked Questions

What is the IUPAC name of N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide?
The IUPAC name of N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide (CID 171492021) is N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide.
What is the SMILES notation for N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide?
The canonical SMILES for N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide is Cc1ccc(NC(=O)c2cc3n(n2)CCCO3)nc1N1CCN(C)CC1.
What is the InChIKey of N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide?
The InChIKey is CLKMHIHIEHPSAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6O2/c1-13-4-5-15(19-17(13)23-9-7-22(2)8-10-23)20-18(25)14-12-16-24(21-14)6-3-11-26-16/h4-5,12H,3,6-11H2,1-2H3,(H,19,20,25).
What are the key properties of N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide?
N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide has a molecular weight of 356.43 g/mol, XLogP of 1.37, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide is sourced from PubChem (CID 171492021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).