6-methyl-4-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]furo[2,3-d]pyrimidine-5-carboxamide

C17H22N4O4 — CID 92745643

IUPAC6-methyl-4-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]furo[2,3-d]pyrimidine-5-carboxamide
SMILESCc1oc2ncnc(N3CCOCC3)c2c1C(=O)NC[C@@H]1CCCO1
InChIInChI=1S/C17H22N4O4/c1-11-13(16(22)18-9-12-3-2-6-24-12)14-15(19-10-20-17(14)25-11)21-4-7-23-8-5-21/h10,12H,2-9H2,1H3,(H,18,22)/t12-/m0/s1
InChIKeyAFMAIZJSTHSVGV-LBPRGKRZSA-N
MW346.39 g/mol
LogP1.28
Rot. Bonds4

About 6-methyl-4-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]furo[2,3-d]pyrimidine-5-carboxamide

6-methyl-4-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]furo[2,3-d]pyrimidine-5-carboxamide (PubChem CID 92745643) has the molecular formula C17H22N4O4 and a molecular weight of 346.39 g/mol. Its IUPAC name is 6-methyl-4-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]furo[2,3-d]pyrimidine-5-carboxamide.

Molecular Properties

Compound Name6-methyl-4-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]furo[2,3-d]pyrimidine-5-carboxamide
PubChem CID92745643
Molecular FormulaC17H22N4O4
Molecular Weight346.39 g/mol
Exact Mass346.16
IUPAC Name6-methyl-4-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]furo[2,3-d]pyrimidine-5-carboxamide
SMILESCc1oc2ncnc(N3CCOCC3)c2c1C(=O)NC[C@@H]1CCCO1
InChIInChI=1S/C17H22N4O4/c1-11-13(16(22)18-9-12-3-2-6-24-12)14-15(19-10-20-17(14)25-11)21-4-7-23-8-5-21/h10,12H,2-9H2,1H3,(H,18,22)/t12-/m0/s1
InChIKeyAFMAIZJSTHSVGV-LBPRGKRZSA-N
XLogP1.28
TPSA89.72 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.39
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 6-methyl-4-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]furo[2,3-d]pyrimidine-5-carboxamide with MolForge

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Related Compounds

6-methyl-4-morpholin-4-yl-N-(oxolan-2-ylmethyl)furo[2,3-d]pyrimidine-5-carboxamide
CID 45106699
N,N-diethyl-6-methyl-4-morpholin-4-ylfuro[2,3-d]pyrimidine-5-carboxamide
CID 20925298
N-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methyl]-6-methyl-4-morpholin-4-ylfuro[2,3-d]pyrimidine-5-carboxamide
CID 20925403
N-cyclohexyl-6-methyl-4-morpholin-4-yl-N-propan-2-ylfuro[2,3-d]pyrimidine-5-carboxamide
CID 20925367
N,6-dimethyl-N-(2-methylphenyl)-4-morpholin-4-ylfuro[2,3-d]pyrimidine-5-carboxamide
CID 20925317
N-(2-methoxyphenyl)-6-methyl-4-morpholin-4-ylfuro[2,3-d]pyrimidine-5-carboxamide
CID 20925246
6-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide
CID 724881
1-(6-morpholin-4-ylpyrimidin-4-yl)-N-[[(2S)-oxolan-2-yl]methyl]imidazole-4-carboxamide
CID 95102243
N-(2-ethoxyphenyl)-N,6-dimethyl-4-morpholin-4-ylfuro[2,3-d]pyrimidine-5-carboxamide
CID 20925311
2,4,6-trimethyl-1-N,3-N-bis(oxolan-2-ylmethyl)benzene-1,3-dicarboxamide
CID 3519038
4-methyl-N-(oxolan-2-ylmethyl)-2-piperidin-1-ylpyrimidine-5-carboxamide
CID 66505270
2-(azepan-1-yl)-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 3192331

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]furo[2,3-d]pyrimidine-5-carboxamide?
The IUPAC name of 6-methyl-4-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]furo[2,3-d]pyrimidine-5-carboxamide (CID 92745643) is 6-methyl-4-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]furo[2,3-d]pyrimidine-5-carboxamide.
What is the SMILES notation for 6-methyl-4-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]furo[2,3-d]pyrimidine-5-carboxamide?
The canonical SMILES for 6-methyl-4-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]furo[2,3-d]pyrimidine-5-carboxamide is Cc1oc2ncnc(N3CCOCC3)c2c1C(=O)NC[C@@H]1CCCO1.
What is the InChIKey of 6-methyl-4-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]furo[2,3-d]pyrimidine-5-carboxamide?
The InChIKey is AFMAIZJSTHSVGV-LBPRGKRZSA-N. The full InChI is InChI=1S/C17H22N4O4/c1-11-13(16(22)18-9-12-3-2-6-24-12)14-15(19-10-20-17(14)25-11)21-4-7-23-8-5-21/h10,12H,2-9H2,1H3,(H,18,22)/t12-/m0/s1.
What are the key properties of 6-methyl-4-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]furo[2,3-d]pyrimidine-5-carboxamide?
6-methyl-4-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]furo[2,3-d]pyrimidine-5-carboxamide has a molecular weight of 346.39 g/mol, XLogP of 1.28, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]furo[2,3-d]pyrimidine-5-carboxamide is sourced from PubChem (CID 92745643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).