methyl 7-(morpholine-4-carbonyl)pyrido[1,2-a]indole-10-carboxylate

C19H18N2O4 — CID 66667084

IUPACmethyl 7-(morpholine-4-carbonyl)pyrido[1,2-a]indole-10-carboxylate
SMILESCOC(=O)c1c2ccccc2n2cc(C(=O)N3CCOCC3)ccc12
InChIInChI=1S/C19H18N2O4/c1-24-19(23)17-14-4-2-3-5-15(14)21-12-13(6-7-16(17)21)18(22)20-8-10-25-11-9-20/h2-7,12H,8-11H2,1H3
InChIKeyOXDCSULKGVSNRI-UHFFFAOYSA-N
MW338.36 g/mol
LogP2.35
Rot. Bonds2

About methyl 7-(morpholine-4-carbonyl)pyrido[1,2-a]indole-10-carboxylate

methyl 7-(morpholine-4-carbonyl)pyrido[1,2-a]indole-10-carboxylate (PubChem CID 66667084) has the molecular formula C19H18N2O4 and a molecular weight of 338.36 g/mol. Its IUPAC name is methyl 7-(morpholine-4-carbonyl)pyrido[1,2-a]indole-10-carboxylate.

Molecular Properties

Compound Namemethyl 7-(morpholine-4-carbonyl)pyrido[1,2-a]indole-10-carboxylate
PubChem CID66667084
Molecular FormulaC19H18N2O4
Molecular Weight338.36 g/mol
Exact Mass338.13
IUPAC Namemethyl 7-(morpholine-4-carbonyl)pyrido[1,2-a]indole-10-carboxylate
SMILESCOC(=O)c1c2ccccc2n2cc(C(=O)N3CCOCC3)ccc12
InChIInChI=1S/C19H18N2O4/c1-24-19(23)17-14-4-2-3-5-15(14)21-12-13(6-7-16(17)21)18(22)20-8-10-25-11-9-20/h2-7,12H,8-11H2,1H3
InChIKeyOXDCSULKGVSNRI-UHFFFAOYSA-N
XLogP2.35
TPSA60.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.36
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 7-(2-morpholin-4-ylacetyl)pyrido[1,2-a]indole-10-carboxylate
CID 66667489
methyl 7-(2-hydroxyacetyl)pyrido[1,2-a]indole-10-carboxylate
CID 66667573
methyl 7-(2-methylsulfinylacetyl)pyrido[1,2-a]indole-10-carboxylate
CID 66667983
methyl 7-phenylmethoxypyrido[1,2-a]indole-10-carboxylate
CID 66667117
methyl 7-(2-chloroethylsulfinyl)pyrido[1,2-a]indole-10-carboxylate
CID 66667495
methyl 4-(morpholine-4-carbothioyl)benzoate
CID 974575
(3,4-dimethoxyphenyl)-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)methanone
CID 4600615
methyl 7-(4-amino-4-oxobutan-2-yl)oxypyrido[1,2-a]indole-10-carboxylate
CID 66667086
methyl 4-[[3-(morpholine-4-carbonyl)quinolin-4-yl]amino]benzoate
CID 53001664
methyl 6-(morpholine-4-carbonyl)pyridine-2-carboxylate
CID 47244996
methyl 9-(oxan-4-yl)carbazole-3-carboxylate
CID 59626411
[4-(4-methoxyphenyl)phenyl]-morpholin-4-ylmethanone
CID 3530238

Frequently Asked Questions

What is the IUPAC name of methyl 7-(morpholine-4-carbonyl)pyrido[1,2-a]indole-10-carboxylate?
The IUPAC name of methyl 7-(morpholine-4-carbonyl)pyrido[1,2-a]indole-10-carboxylate (CID 66667084) is methyl 7-(morpholine-4-carbonyl)pyrido[1,2-a]indole-10-carboxylate.
What is the SMILES notation for methyl 7-(morpholine-4-carbonyl)pyrido[1,2-a]indole-10-carboxylate?
The canonical SMILES for methyl 7-(morpholine-4-carbonyl)pyrido[1,2-a]indole-10-carboxylate is COC(=O)c1c2ccccc2n2cc(C(=O)N3CCOCC3)ccc12.
What is the InChIKey of methyl 7-(morpholine-4-carbonyl)pyrido[1,2-a]indole-10-carboxylate?
The InChIKey is OXDCSULKGVSNRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O4/c1-24-19(23)17-14-4-2-3-5-15(14)21-12-13(6-7-16(17)21)18(22)20-8-10-25-11-9-20/h2-7,12H,8-11H2,1H3.
What are the key properties of methyl 7-(morpholine-4-carbonyl)pyrido[1,2-a]indole-10-carboxylate?
methyl 7-(morpholine-4-carbonyl)pyrido[1,2-a]indole-10-carboxylate has a molecular weight of 338.36 g/mol, XLogP of 2.35, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 7-(morpholine-4-carbonyl)pyrido[1,2-a]indole-10-carboxylate is sourced from PubChem (CID 66667084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).