4-(4,6-dimethylpyrimidin-2-yl)morpholine-3-carboxamide

C11H16N4O2 — CID 75483897

IUPAC4-(4,6-dimethylpyrimidin-2-yl)morpholine-3-carboxamide
SMILESCc1cc(C)nc(N2CCOCC2C(N)=O)n1
InChIInChI=1S/C11H16N4O2/c1-7-5-8(2)14-11(13-7)15-3-4-17-6-9(15)10(12)16/h5,9H,3-4,6H2,1-2H3,(H2,12,16)
InChIKeyKHKCOXUSOYYXJA-UHFFFAOYSA-N
MW236.27 g/mol
LogP-0.22
Rot. Bonds2

About 4-(4,6-dimethylpyrimidin-2-yl)morpholine-3-carboxamide

4-(4,6-dimethylpyrimidin-2-yl)morpholine-3-carboxamide (PubChem CID 75483897) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is 4-(4,6-dimethylpyrimidin-2-yl)morpholine-3-carboxamide.

Molecular Properties

Compound Name4-(4,6-dimethylpyrimidin-2-yl)morpholine-3-carboxamide
PubChem CID75483897
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC Name4-(4,6-dimethylpyrimidin-2-yl)morpholine-3-carboxamide
SMILESCc1cc(C)nc(N2CCOCC2C(N)=O)n1
InChIInChI=1S/C11H16N4O2/c1-7-5-8(2)14-11(13-7)15-3-4-17-6-9(15)10(12)16/h5,9H,3-4,6H2,1-2H3,(H2,12,16)
InChIKeyKHKCOXUSOYYXJA-UHFFFAOYSA-N
XLogP-0.22
TPSA81.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 5-0.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(4-cyano-6-methylpyrimidin-2-yl)morpholine-3-carboxamide
CID 107545048
4-[2-(ethylamino)-6-methylpyrimidin-4-yl]morpholine-3-carboxamide
CID 83106116
4-(3-amino-4-methylphenyl)morpholine-3-carboxamide
CID 83101423
4-(4-amino-6-methoxy-1,3,5-triazin-2-yl)morpholine-3-carboxamide
CID 83095941
4-(3-carbamoylmorpholin-4-yl)-2-methylbenzoic acid
CID 83096397
4-[4-(hydroxymethyl)-3-methylphenyl]morpholine-3-carboxamide
CID 83096488
4-(4-cyano-6-methylpyrimidin-2-yl)-N-methylmorpholine-3-carboxamide
CID 107545051
4-(3-amino-5-methylphenyl)morpholine-3-carboxamide
CID 112648201
4-(3-amino-5-methyl-2-pyridinyl)morpholine-3-carboxamide
CID 83101058
4-(6-methyl-5-nitro-2-pyridinyl)morpholine-3-carboxamide
CID 133452657
4-(4-cyano-6-methylpyrimidin-2-yl)-N-propylmorpholine-3-carboxamide
CID 107545052
4-(4-cyano-6-methylpyrimidin-2-yl)-N-cyclopropylmorpholine-3-carboxamide
CID 107545054

Frequently Asked Questions

What is the IUPAC name of 4-(4,6-dimethylpyrimidin-2-yl)morpholine-3-carboxamide?
The IUPAC name of 4-(4,6-dimethylpyrimidin-2-yl)morpholine-3-carboxamide (CID 75483897) is 4-(4,6-dimethylpyrimidin-2-yl)morpholine-3-carboxamide.
What is the SMILES notation for 4-(4,6-dimethylpyrimidin-2-yl)morpholine-3-carboxamide?
The canonical SMILES for 4-(4,6-dimethylpyrimidin-2-yl)morpholine-3-carboxamide is Cc1cc(C)nc(N2CCOCC2C(N)=O)n1.
What is the InChIKey of 4-(4,6-dimethylpyrimidin-2-yl)morpholine-3-carboxamide?
The InChIKey is KHKCOXUSOYYXJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c1-7-5-8(2)14-11(13-7)15-3-4-17-6-9(15)10(12)16/h5,9H,3-4,6H2,1-2H3,(H2,12,16).
What are the key properties of 4-(4,6-dimethylpyrimidin-2-yl)morpholine-3-carboxamide?
4-(4,6-dimethylpyrimidin-2-yl)morpholine-3-carboxamide has a molecular weight of 236.27 g/mol, XLogP of -0.22, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,6-dimethylpyrimidin-2-yl)morpholine-3-carboxamide is sourced from PubChem (CID 75483897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).