N-[3-(dipropylamino)propyl]-7-methoxyfuro[2,3-b]quinoline-2-carboxamide

C22H29N3O3 — CID 3236862

IUPACN-[3-(dipropylamino)propyl]-7-methoxyfuro[2,3-b]quinoline-2-carboxamide
SMILESCCCN(CCC)CCCNC(=O)c1cc2cc3ccc(OC)cc3nc2o1
InChIInChI=1S/C22H29N3O3/c1-4-10-25(11-5-2)12-6-9-23-21(26)20-14-17-13-16-7-8-18(27-3)15-19(16)24-22(17)28-20/h7-8,13-15H,4-6,9-12H2,1-3H3,(H,23,26)
InChIKeySREITWSGXSNLBY-UHFFFAOYSA-N
MW383.49 g/mol
LogP4.23
Rot. Bonds10

About N-[3-(dipropylamino)propyl]-7-methoxyfuro[2,3-b]quinoline-2-carboxamide

N-[3-(dipropylamino)propyl]-7-methoxyfuro[2,3-b]quinoline-2-carboxamide (PubChem CID 3236862) has the molecular formula C22H29N3O3 and a molecular weight of 383.49 g/mol. Its IUPAC name is N-[3-(dipropylamino)propyl]-7-methoxyfuro[2,3-b]quinoline-2-carboxamide.

Molecular Properties

Compound NameN-[3-(dipropylamino)propyl]-7-methoxyfuro[2,3-b]quinoline-2-carboxamide
PubChem CID3236862
Molecular FormulaC22H29N3O3
Molecular Weight383.49 g/mol
Exact Mass383.22
IUPAC NameN-[3-(dipropylamino)propyl]-7-methoxyfuro[2,3-b]quinoline-2-carboxamide
SMILESCCCN(CCC)CCCNC(=O)c1cc2cc3ccc(OC)cc3nc2o1
InChIInChI=1S/C22H29N3O3/c1-4-10-25(11-5-2)12-6-9-23-21(26)20-14-17-13-16-7-8-18(27-3)15-19(16)24-22(17)28-20/h7-8,13-15H,4-6,9-12H2,1-3H3,(H,23,26)
InChIKeySREITWSGXSNLBY-UHFFFAOYSA-N
XLogP4.23
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.49
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[3-(dipropylamino)propyl]-7-methoxyfuro[2,3-b]quinoline-2-carboxamide?
The IUPAC name of N-[3-(dipropylamino)propyl]-7-methoxyfuro[2,3-b]quinoline-2-carboxamide (CID 3236862) is N-[3-(dipropylamino)propyl]-7-methoxyfuro[2,3-b]quinoline-2-carboxamide.
What is the SMILES notation for N-[3-(dipropylamino)propyl]-7-methoxyfuro[2,3-b]quinoline-2-carboxamide?
The canonical SMILES for N-[3-(dipropylamino)propyl]-7-methoxyfuro[2,3-b]quinoline-2-carboxamide is CCCN(CCC)CCCNC(=O)c1cc2cc3ccc(OC)cc3nc2o1.
What is the InChIKey of N-[3-(dipropylamino)propyl]-7-methoxyfuro[2,3-b]quinoline-2-carboxamide?
The InChIKey is SREITWSGXSNLBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3O3/c1-4-10-25(11-5-2)12-6-9-23-21(26)20-14-17-13-16-7-8-18(27-3)15-19(16)24-22(17)28-20/h7-8,13-15H,4-6,9-12H2,1-3H3,(H,23,26).
What are the key properties of N-[3-(dipropylamino)propyl]-7-methoxyfuro[2,3-b]quinoline-2-carboxamide?
N-[3-(dipropylamino)propyl]-7-methoxyfuro[2,3-b]quinoline-2-carboxamide has a molecular weight of 383.49 g/mol, XLogP of 4.23, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dipropylamino)propyl]-7-methoxyfuro[2,3-b]quinoline-2-carboxamide is sourced from PubChem (CID 3236862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).