N-(4-cyclopropyl-2-methylpyrimidin-5-yl)-2-methyloxane-3-carboxamide

C15H21N3O2 — CID 154755598

IUPACN-(4-cyclopropyl-2-methylpyrimidin-5-yl)-2-methyloxane-3-carboxamide
SMILESCc1ncc(NC(=O)C2CCCOC2C)c(C2CC2)n1
InChIInChI=1S/C15H21N3O2/c1-9-12(4-3-7-20-9)15(19)18-13-8-16-10(2)17-14(13)11-5-6-11/h8-9,11-12H,3-7H2,1-2H3,(H,18,19)
InChIKeySIDKUUPLXGWXCW-UHFFFAOYSA-N
MW275.35 g/mol
LogP2.42
Rot. Bonds3

About N-(4-cyclopropyl-2-methylpyrimidin-5-yl)-2-methyloxane-3-carboxamide

N-(4-cyclopropyl-2-methylpyrimidin-5-yl)-2-methyloxane-3-carboxamide (PubChem CID 154755598) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is N-(4-cyclopropyl-2-methylpyrimidin-5-yl)-2-methyloxane-3-carboxamide.

Molecular Properties

Compound NameN-(4-cyclopropyl-2-methylpyrimidin-5-yl)-2-methyloxane-3-carboxamide
PubChem CID154755598
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC NameN-(4-cyclopropyl-2-methylpyrimidin-5-yl)-2-methyloxane-3-carboxamide
SMILESCc1ncc(NC(=O)C2CCCOC2C)c(C2CC2)n1
InChIInChI=1S/C15H21N3O2/c1-9-12(4-3-7-20-9)15(19)18-13-8-16-10(2)17-14(13)11-5-6-11/h8-9,11-12H,3-7H2,1-2H3,(H,18,19)
InChIKeySIDKUUPLXGWXCW-UHFFFAOYSA-N
XLogP2.42
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-cyclopropyl-2-methylpyrimidin-5-yl)-2-methyloxane-3-carboxamide?
The IUPAC name of N-(4-cyclopropyl-2-methylpyrimidin-5-yl)-2-methyloxane-3-carboxamide (CID 154755598) is N-(4-cyclopropyl-2-methylpyrimidin-5-yl)-2-methyloxane-3-carboxamide.
What is the SMILES notation for N-(4-cyclopropyl-2-methylpyrimidin-5-yl)-2-methyloxane-3-carboxamide?
The canonical SMILES for N-(4-cyclopropyl-2-methylpyrimidin-5-yl)-2-methyloxane-3-carboxamide is Cc1ncc(NC(=O)C2CCCOC2C)c(C2CC2)n1.
What is the InChIKey of N-(4-cyclopropyl-2-methylpyrimidin-5-yl)-2-methyloxane-3-carboxamide?
The InChIKey is SIDKUUPLXGWXCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-9-12(4-3-7-20-9)15(19)18-13-8-16-10(2)17-14(13)11-5-6-11/h8-9,11-12H,3-7H2,1-2H3,(H,18,19).
What are the key properties of N-(4-cyclopropyl-2-methylpyrimidin-5-yl)-2-methyloxane-3-carboxamide?
N-(4-cyclopropyl-2-methylpyrimidin-5-yl)-2-methyloxane-3-carboxamide has a molecular weight of 275.35 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclopropyl-2-methylpyrimidin-5-yl)-2-methyloxane-3-carboxamide is sourced from PubChem (CID 154755598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).