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

C14H22N4O2 — CID 90537015

IUPACN-methyl-N-(1-methylpiperidin-4-yl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide
SMILESCN1CCC(N(C)C(=O)c2cnn3c2OCCC3)CC1
InChIInChI=1S/C14H22N4O2/c1-16-7-4-11(5-8-16)17(2)13(19)12-10-15-18-6-3-9-20-14(12)18/h10-11H,3-9H2,1-2H3
InChIKeyHZMICUGLZQRBMU-UHFFFAOYSA-N
MW278.36 g/mol
LogP0.83
Rot. Bonds2

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

N-methyl-N-(1-methylpiperidin-4-yl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide (PubChem CID 90537015) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is N-methyl-N-(1-methylpiperidin-4-yl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(1-methylpiperidin-4-yl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide
PubChem CID90537015
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC NameN-methyl-N-(1-methylpiperidin-4-yl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide
SMILESCN1CCC(N(C)C(=O)c2cnn3c2OCCC3)CC1
InChIInChI=1S/C14H22N4O2/c1-16-7-4-11(5-8-16)17(2)13(19)12-10-15-18-6-3-9-20-14(12)18/h10-11H,3-9H2,1-2H3
InChIKeyHZMICUGLZQRBMU-UHFFFAOYSA-N
XLogP0.83
TPSA50.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-methylpiperidin-4-yl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide?
The IUPAC name of N-methyl-N-(1-methylpiperidin-4-yl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide (CID 90537015) is N-methyl-N-(1-methylpiperidin-4-yl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide.
What is the SMILES notation for N-methyl-N-(1-methylpiperidin-4-yl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide?
The canonical SMILES for N-methyl-N-(1-methylpiperidin-4-yl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide is CN1CCC(N(C)C(=O)c2cnn3c2OCCC3)CC1.
What is the InChIKey of N-methyl-N-(1-methylpiperidin-4-yl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide?
The InChIKey is HZMICUGLZQRBMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-16-7-4-11(5-8-16)17(2)13(19)12-10-15-18-6-3-9-20-14(12)18/h10-11H,3-9H2,1-2H3.
What are the key properties of N-methyl-N-(1-methylpiperidin-4-yl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide?
N-methyl-N-(1-methylpiperidin-4-yl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide has a molecular weight of 278.36 g/mol, XLogP of 0.83, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-methylpiperidin-4-yl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide is sourced from PubChem (CID 90537015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).