N-cyclohexyl-N-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide

C16H25N3O2 — CID 90537012

IUPACN-cyclohexyl-N-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide
SMILESCC(C)N(C(=O)c1cnn2c1OCCC2)C1CCCCC1
InChIInChI=1S/C16H25N3O2/c1-12(2)19(13-7-4-3-5-8-13)15(20)14-11-17-18-9-6-10-21-16(14)18/h11-13H,3-10H2,1-2H3
InChIKeyQSUYFYJETPRMIF-UHFFFAOYSA-N
MW291.40 g/mol
LogP2.85
Rot. Bonds3

About N-cyclohexyl-N-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide

N-cyclohexyl-N-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide (PubChem CID 90537012) has the molecular formula C16H25N3O2 and a molecular weight of 291.40 g/mol. Its IUPAC name is N-cyclohexyl-N-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-N-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide
PubChem CID90537012
Molecular FormulaC16H25N3O2
Molecular Weight291.40 g/mol
Exact Mass291.19
IUPAC NameN-cyclohexyl-N-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide
SMILESCC(C)N(C(=O)c1cnn2c1OCCC2)C1CCCCC1
InChIInChI=1S/C16H25N3O2/c1-12(2)19(13-7-4-3-5-8-13)15(20)14-11-17-18-9-6-10-21-16(14)18/h11-13H,3-10H2,1-2H3
InChIKeyQSUYFYJETPRMIF-UHFFFAOYSA-N
XLogP2.85
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide?
The IUPAC name of N-cyclohexyl-N-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide (CID 90537012) is N-cyclohexyl-N-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-N-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-N-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide is CC(C)N(C(=O)c1cnn2c1OCCC2)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide?
The InChIKey is QSUYFYJETPRMIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-12(2)19(13-7-4-3-5-8-13)15(20)14-11-17-18-9-6-10-21-16(14)18/h11-13H,3-10H2,1-2H3.
What are the key properties of N-cyclohexyl-N-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide?
N-cyclohexyl-N-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide has a molecular weight of 291.40 g/mol, XLogP of 2.85, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide is sourced from PubChem (CID 90537012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).