2-methoxy-N-methyl-N-[3-[(2R)-oxolan-2-yl]propyl]pyrimidine-5-carboxamide

C14H21N3O3 — CID 126439627

IUPAC2-methoxy-N-methyl-N-[3-[(2R)-oxolan-2-yl]propyl]pyrimidine-5-carboxamide
SMILESCOc1ncc(C(=O)N(C)CCC[C@@H]2CCCO2)cn1
InChIInChI=1S/C14H21N3O3/c1-17(7-3-5-12-6-4-8-20-12)13(18)11-9-15-14(19-2)16-10-11/h9-10,12H,3-8H2,1-2H3/t12-/m1/s1
InChIKeyNXBNPFHZSXEPPR-GFCCVEGCSA-N
MW279.34 g/mol
LogP1.52
Rot. Bonds6

About 2-methoxy-N-methyl-N-[3-[(2R)-oxolan-2-yl]propyl]pyrimidine-5-carboxamide

2-methoxy-N-methyl-N-[3-[(2R)-oxolan-2-yl]propyl]pyrimidine-5-carboxamide (PubChem CID 126439627) has the molecular formula C14H21N3O3 and a molecular weight of 279.34 g/mol. Its IUPAC name is 2-methoxy-N-methyl-N-[3-[(2R)-oxolan-2-yl]propyl]pyrimidine-5-carboxamide.

Molecular Properties

Compound Name2-methoxy-N-methyl-N-[3-[(2R)-oxolan-2-yl]propyl]pyrimidine-5-carboxamide
PubChem CID126439627
Molecular FormulaC14H21N3O3
Molecular Weight279.34 g/mol
Exact Mass279.16
IUPAC Name2-methoxy-N-methyl-N-[3-[(2R)-oxolan-2-yl]propyl]pyrimidine-5-carboxamide
SMILESCOc1ncc(C(=O)N(C)CCC[C@@H]2CCCO2)cn1
InChIInChI=1S/C14H21N3O3/c1-17(7-3-5-12-6-4-8-20-12)13(18)11-9-15-14(19-2)16-10-11/h9-10,12H,3-8H2,1-2H3/t12-/m1/s1
InChIKeyNXBNPFHZSXEPPR-GFCCVEGCSA-N
XLogP1.52
TPSA64.55 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3,5-difluoro-N-methyl-N-[3-(oxolan-2-yl)propyl]pyridine-2-carboxamide
CID 91776280
N-methyl-4-(3-methyl-4-pyridinyl)-N-[3-(oxolan-2-yl)propyl]benzamide
CID 119067493
5-chloro-7-methoxy-N-methyl-N-[3-(oxolan-2-yl)propyl]-1-benzofuran-2-carboxamide
CID 118784606
N-methyl-N-[3-[(2S)-oxolan-2-yl]propyl]-3-(piperidine-1-carbonyl)pyrazine-2-carboxamide
CID 125168534
5-(difluoromethyl)-N-methyl-N-[3-(oxolan-2-yl)propyl]-1H-pyrazole-3-carboxamide
CID 121495548
3-(3-fluoro-4-pyridinyl)-N-methyl-N-[3-[(2S)-oxolan-2-yl]propyl]benzamide
CID 125159693
N-methyl-6-oxo-N-[3-(oxolan-2-yl)propyl]-2-pyridin-2-yl-1H-pyrimidine-5-carboxamide
CID 70734672
2-[3-[methyl-[3-(oxolan-2-yl)propyl]carbamoyl]phenyl]pyridine-3-carboxamide
CID 118787231
8-fluoro-N-methyl-N-[3-[(2S)-oxolan-2-yl]propyl]quinoline-2-carboxamide
CID 97128255
N-methyl-N-[3-(oxolan-2-yl)propyl]-2-pyridin-3-ylacetamide
CID 91760229
3-(6-cyano-2-pyridinyl)-N-methyl-N-[3-[(2R)-oxolan-2-yl]propyl]benzamide
CID 126444243
N-methyl-6-oxo-N-[3-[(2S)-oxolan-2-yl]propyl]-2-pyridin-3-yl-1H-pyrimidine-5-carboxamide
CID 97156070

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methyl-N-[3-[(2R)-oxolan-2-yl]propyl]pyrimidine-5-carboxamide?
The IUPAC name of 2-methoxy-N-methyl-N-[3-[(2R)-oxolan-2-yl]propyl]pyrimidine-5-carboxamide (CID 126439627) is 2-methoxy-N-methyl-N-[3-[(2R)-oxolan-2-yl]propyl]pyrimidine-5-carboxamide.
What is the SMILES notation for 2-methoxy-N-methyl-N-[3-[(2R)-oxolan-2-yl]propyl]pyrimidine-5-carboxamide?
The canonical SMILES for 2-methoxy-N-methyl-N-[3-[(2R)-oxolan-2-yl]propyl]pyrimidine-5-carboxamide is COc1ncc(C(=O)N(C)CCC[C@@H]2CCCO2)cn1.
What is the InChIKey of 2-methoxy-N-methyl-N-[3-[(2R)-oxolan-2-yl]propyl]pyrimidine-5-carboxamide?
The InChIKey is NXBNPFHZSXEPPR-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H21N3O3/c1-17(7-3-5-12-6-4-8-20-12)13(18)11-9-15-14(19-2)16-10-11/h9-10,12H,3-8H2,1-2H3/t12-/m1/s1.
What are the key properties of 2-methoxy-N-methyl-N-[3-[(2R)-oxolan-2-yl]propyl]pyrimidine-5-carboxamide?
2-methoxy-N-methyl-N-[3-[(2R)-oxolan-2-yl]propyl]pyrimidine-5-carboxamide has a molecular weight of 279.34 g/mol, XLogP of 1.52, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methyl-N-[3-[(2R)-oxolan-2-yl]propyl]pyrimidine-5-carboxamide is sourced from PubChem (CID 126439627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).