N-(2-methoxyethyl)-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]furan-2-carboxamide

C19H19N5O3 — CID 3227710

IUPACN-(2-methoxyethyl)-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]furan-2-carboxamide
SMILESCOCCN(Cc1cc2ccc(C)cc2n2nnnc12)C(=O)c1ccco1
InChIInChI=1S/C19H19N5O3/c1-13-5-6-14-11-15(18-20-21-22-24(18)16(14)10-13)12-23(7-9-26-2)19(25)17-4-3-8-27-17/h3-6,8,10-11H,7,9,12H2,1-2H3
InChIKeyQAEHBZCRQTYQNB-UHFFFAOYSA-N
MW365.39 g/mol
LogP2.47
Rot. Bonds6

About N-(2-methoxyethyl)-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]furan-2-carboxamide

N-(2-methoxyethyl)-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]furan-2-carboxamide (PubChem CID 3227710) has the molecular formula C19H19N5O3 and a molecular weight of 365.39 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]furan-2-carboxamide
PubChem CID3227710
Molecular FormulaC19H19N5O3
Molecular Weight365.39 g/mol
Exact Mass365.15
IUPAC NameN-(2-methoxyethyl)-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]furan-2-carboxamide
SMILESCOCCN(Cc1cc2ccc(C)cc2n2nnnc12)C(=O)c1ccco1
InChIInChI=1S/C19H19N5O3/c1-13-5-6-14-11-15(18-20-21-22-24(18)16(14)10-13)12-23(7-9-26-2)19(25)17-4-3-8-27-17/h3-6,8,10-11H,7,9,12H2,1-2H3
InChIKeyQAEHBZCRQTYQNB-UHFFFAOYSA-N
XLogP2.47
TPSA85.76 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]furan-2-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]furan-2-carboxamide (CID 3227710) is N-(2-methoxyethyl)-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]furan-2-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]furan-2-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]furan-2-carboxamide is COCCN(Cc1cc2ccc(C)cc2n2nnnc12)C(=O)c1ccco1.
What is the InChIKey of N-(2-methoxyethyl)-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]furan-2-carboxamide?
The InChIKey is QAEHBZCRQTYQNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O3/c1-13-5-6-14-11-15(18-20-21-22-24(18)16(14)10-13)12-23(7-9-26-2)19(25)17-4-3-8-27-17/h3-6,8,10-11H,7,9,12H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]furan-2-carboxamide?
N-(2-methoxyethyl)-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]furan-2-carboxamide has a molecular weight of 365.39 g/mol, XLogP of 2.47, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]furan-2-carboxamide is sourced from PubChem (CID 3227710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).