2-ethoxy-6-[[(2S)-oxolan-2-yl]methoxy]quinazoline

C15H18N2O3 — CID 91462378

IUPAC2-ethoxy-6-[[(2S)-oxolan-2-yl]methoxy]quinazoline
SMILESCCOc1ncc2cc(OC[C@@H]3CCCO3)ccc2n1
InChIInChI=1S/C15H18N2O3/c1-2-18-15-16-9-11-8-12(5-6-14(11)17-15)20-10-13-4-3-7-19-13/h5-6,8-9,13H,2-4,7,10H2,1H3/t13-/m0/s1
InChIKeyJLJYCQDMSMJJLL-ZDUSSCGKSA-N
MW274.32 g/mol
LogP2.59
Rot. Bonds5

About 2-ethoxy-6-[[(2S)-oxolan-2-yl]methoxy]quinazoline

2-ethoxy-6-[[(2S)-oxolan-2-yl]methoxy]quinazoline (PubChem CID 91462378) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is 2-ethoxy-6-[[(2S)-oxolan-2-yl]methoxy]quinazoline.

Molecular Properties

Compound Name2-ethoxy-6-[[(2S)-oxolan-2-yl]methoxy]quinazoline
PubChem CID91462378
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC Name2-ethoxy-6-[[(2S)-oxolan-2-yl]methoxy]quinazoline
SMILESCCOc1ncc2cc(OC[C@@H]3CCCO3)ccc2n1
InChIInChI=1S/C15H18N2O3/c1-2-18-15-16-9-11-8-12(5-6-14(11)17-15)20-10-13-4-3-7-19-13/h5-6,8-9,13H,2-4,7,10H2,1H3/t13-/m0/s1
InChIKeyJLJYCQDMSMJJLL-ZDUSSCGKSA-N
XLogP2.59
TPSA53.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-methyl-2-(oxan-2-ylmethoxy)furo[2,3-d]pyrimidine
CID 142960191
2-[(7-propan-2-ylnaphthalen-2-yl)oxymethyl]oxolane
CID 90144658
1-[3-(oxolan-2-ylmethoxy)phenyl]ethanone
CID 24697722
1-[4-(oxolan-2-ylmethoxy)phenyl]propan-1-one
CID 24702536
2-bromo-5-(oxolan-2-ylmethoxy)pyridine
CID 104853752
1-methyl-4-(oxolan-2-ylmethoxy)pyrazole
CID 116794075
4-(oxolan-2-ylmethoxy)pyridine-2-carbonitrile
CID 62936750
2-[(4-iodophenoxy)methyl]oxolane
CID 60644314
ethyl 3-[4-(2-methoxyethoxy)-2-(oxolan-2-ylmethoxy)phenyl]prop-2-enoate
CID 91354224
N-methyl-4-(oxolan-2-ylmethoxy)aniline
CID 54803460
4-methoxy-3-[7-(oxolan-2-ylmethoxy)naphthalen-2-yl]pyridine
CID 172671316
2-[(3-tert-butylphenoxy)methyl]oxolane
CID 59734486

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-6-[[(2S)-oxolan-2-yl]methoxy]quinazoline?
The IUPAC name of 2-ethoxy-6-[[(2S)-oxolan-2-yl]methoxy]quinazoline (CID 91462378) is 2-ethoxy-6-[[(2S)-oxolan-2-yl]methoxy]quinazoline.
What is the SMILES notation for 2-ethoxy-6-[[(2S)-oxolan-2-yl]methoxy]quinazoline?
The canonical SMILES for 2-ethoxy-6-[[(2S)-oxolan-2-yl]methoxy]quinazoline is CCOc1ncc2cc(OC[C@@H]3CCCO3)ccc2n1.
What is the InChIKey of 2-ethoxy-6-[[(2S)-oxolan-2-yl]methoxy]quinazoline?
The InChIKey is JLJYCQDMSMJJLL-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-2-18-15-16-9-11-8-12(5-6-14(11)17-15)20-10-13-4-3-7-19-13/h5-6,8-9,13H,2-4,7,10H2,1H3/t13-/m0/s1.
What are the key properties of 2-ethoxy-6-[[(2S)-oxolan-2-yl]methoxy]quinazoline?
2-ethoxy-6-[[(2S)-oxolan-2-yl]methoxy]quinazoline has a molecular weight of 274.32 g/mol, XLogP of 2.59, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-6-[[(2S)-oxolan-2-yl]methoxy]quinazoline is sourced from PubChem (CID 91462378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).