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

C20H20N2O4 — CID 66667489

IUPACmethyl 7-(2-morpholin-4-ylacetyl)pyrido[1,2-a]indole-10-carboxylate
SMILESCOC(=O)c1c2ccccc2n2cc(C(=O)CN3CCOCC3)ccc12
InChIInChI=1S/C20H20N2O4/c1-25-20(24)19-15-4-2-3-5-16(15)22-12-14(6-7-17(19)22)18(23)13-21-8-10-26-11-9-21/h2-7,12H,8-11,13H2,1H3
InChIKeyQKBTWSWLRVIPCH-UHFFFAOYSA-N
MW352.39 g/mol
LogP2.39
Rot. Bonds4

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

methyl 7-(2-morpholin-4-ylacetyl)pyrido[1,2-a]indole-10-carboxylate (PubChem CID 66667489) has the molecular formula C20H20N2O4 and a molecular weight of 352.39 g/mol. Its IUPAC name is methyl 7-(2-morpholin-4-ylacetyl)pyrido[1,2-a]indole-10-carboxylate.

Molecular Properties

Compound Namemethyl 7-(2-morpholin-4-ylacetyl)pyrido[1,2-a]indole-10-carboxylate
PubChem CID66667489
Molecular FormulaC20H20N2O4
Molecular Weight352.39 g/mol
Exact Mass352.14
IUPAC Namemethyl 7-(2-morpholin-4-ylacetyl)pyrido[1,2-a]indole-10-carboxylate
SMILESCOC(=O)c1c2ccccc2n2cc(C(=O)CN3CCOCC3)ccc12
InChIInChI=1S/C20H20N2O4/c1-25-20(24)19-15-4-2-3-5-16(15)22-12-14(6-7-17(19)22)18(23)13-21-8-10-26-11-9-21/h2-7,12H,8-11,13H2,1H3
InChIKeyQKBTWSWLRVIPCH-UHFFFAOYSA-N
XLogP2.39
TPSA60.25 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze methyl 7-(2-morpholin-4-ylacetyl)pyrido[1,2-a]indole-10-carboxylate with MolForge

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Related Compounds

methyl 7-(morpholine-4-carbonyl)pyrido[1,2-a]indole-10-carboxylate
CID 66667084
methyl 7-(2-hydroxyacetyl)pyrido[1,2-a]indole-10-carboxylate
CID 66667573
1-(1-methylpyrrol-3-yl)-2-morpholin-4-ylethanone
CID 43227706
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 7-(2-methoxyethylsulfonyl)pyrido[1,2-a]indole-10-carboxylate
CID 66667770
methyl 7-(4-amino-4-oxobutan-2-yl)oxypyrido[1,2-a]indole-10-carboxylate
CID 66667086
1-(3-chloro-4-methoxyphenyl)-2-morpholin-4-ylethanone
CID 43227712
methyl 4-(morpholin-4-ylmethyl)benzoate
CID 10466592
1-(2-methyl-1H-indol-3-yl)-2-morpholin-4-ylethanone
CID 718235
1-(4-bromophenyl)-2-morpholin-4-ylethanone;hydrochloride
CID 24747690
2-morpholin-4-yl-1-(4-propylphenyl)ethanone
CID 43219458

Frequently Asked Questions

What is the IUPAC name of methyl 7-(2-morpholin-4-ylacetyl)pyrido[1,2-a]indole-10-carboxylate?
The IUPAC name of methyl 7-(2-morpholin-4-ylacetyl)pyrido[1,2-a]indole-10-carboxylate (CID 66667489) is methyl 7-(2-morpholin-4-ylacetyl)pyrido[1,2-a]indole-10-carboxylate.
What is the SMILES notation for methyl 7-(2-morpholin-4-ylacetyl)pyrido[1,2-a]indole-10-carboxylate?
The canonical SMILES for methyl 7-(2-morpholin-4-ylacetyl)pyrido[1,2-a]indole-10-carboxylate is COC(=O)c1c2ccccc2n2cc(C(=O)CN3CCOCC3)ccc12.
What is the InChIKey of methyl 7-(2-morpholin-4-ylacetyl)pyrido[1,2-a]indole-10-carboxylate?
The InChIKey is QKBTWSWLRVIPCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O4/c1-25-20(24)19-15-4-2-3-5-16(15)22-12-14(6-7-17(19)22)18(23)13-21-8-10-26-11-9-21/h2-7,12H,8-11,13H2,1H3.
What are the key properties of methyl 7-(2-morpholin-4-ylacetyl)pyrido[1,2-a]indole-10-carboxylate?
methyl 7-(2-morpholin-4-ylacetyl)pyrido[1,2-a]indole-10-carboxylate has a molecular weight of 352.39 g/mol, XLogP of 2.39, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 7-(2-morpholin-4-ylacetyl)pyrido[1,2-a]indole-10-carboxylate is sourced from PubChem (CID 66667489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).