4-[2-(2-methylfuran-3-yl)-2-(propylamino)ethyl]pyridin-2-amine

C15H21N3O — CID 104790403

IUPAC4-[2-(2-methylfuran-3-yl)-2-(propylamino)ethyl]pyridin-2-amine
SMILESCCCNC(Cc1ccnc(N)c1)c1ccoc1C
InChIInChI=1S/C15H21N3O/c1-3-6-17-14(13-5-8-19-11(13)2)9-12-4-7-18-15(16)10-12/h4-5,7-8,10,14,17H,3,6,9H2,1-2H3,(H2,16,18)
InChIKeyOYURKNVSBRZZOR-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.85
Rot. Bonds6

About 4-[2-(2-methylfuran-3-yl)-2-(propylamino)ethyl]pyridin-2-amine

4-[2-(2-methylfuran-3-yl)-2-(propylamino)ethyl]pyridin-2-amine (PubChem CID 104790403) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 4-[2-(2-methylfuran-3-yl)-2-(propylamino)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name4-[2-(2-methylfuran-3-yl)-2-(propylamino)ethyl]pyridin-2-amine
PubChem CID104790403
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name4-[2-(2-methylfuran-3-yl)-2-(propylamino)ethyl]pyridin-2-amine
SMILESCCCNC(Cc1ccnc(N)c1)c1ccoc1C
InChIInChI=1S/C15H21N3O/c1-3-6-17-14(13-5-8-19-11(13)2)9-12-4-7-18-15(16)10-12/h4-5,7-8,10,14,17H,3,6,9H2,1-2H3,(H2,16,18)
InChIKeyOYURKNVSBRZZOR-UHFFFAOYSA-N
XLogP2.85
TPSA64.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[2-hydrazinyl-2-(2-methylfuran-3-yl)ethyl]pyridin-2-amine
CID 105269050
4-[2-(2-fluoro-5-methylphenyl)-2-(propylamino)ethyl]pyridin-2-amine
CID 107931764
4-[2-(2-methylpyrimidin-4-yl)-2-(propylamino)ethyl]pyridin-2-amine
CID 115530998
N-[2-(5-bromo-2-pyridinyl)-1-(2-methylfuran-3-yl)ethyl]propan-1-amine
CID 104804098
N-[2-methoxy-1-(2-methylfuran-3-yl)ethyl]propan-1-amine
CID 104790452
4-[3-propan-2-ylsulfanyl-2-(propylamino)propyl]pyridin-2-amine
CID 65132138
N-[1-(2-chlorofuran-3-yl)-2-(3,4-difluorophenyl)ethyl]propan-1-amine
CID 106687928
4-[3-ethoxy-2-(propylamino)butyl]pyridin-2-amine
CID 64533806
N-[1-(2-chlorofuran-3-yl)-2-(3-chlorophenyl)ethyl]propan-1-amine
CID 106687887
N-[2-(4-bromo-2-fluorophenyl)-1-(2-methylfuran-3-yl)ethyl]propan-1-amine
CID 104790489
4-[3-methoxy-2-(propylamino)hexyl]pyridin-2-amine
CID 116719566
4-[3-ethoxy-3-methyl-2-(propylamino)butyl]pyridin-2-amine
CID 116727253

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-methylfuran-3-yl)-2-(propylamino)ethyl]pyridin-2-amine?
The IUPAC name of 4-[2-(2-methylfuran-3-yl)-2-(propylamino)ethyl]pyridin-2-amine (CID 104790403) is 4-[2-(2-methylfuran-3-yl)-2-(propylamino)ethyl]pyridin-2-amine.
What is the SMILES notation for 4-[2-(2-methylfuran-3-yl)-2-(propylamino)ethyl]pyridin-2-amine?
The canonical SMILES for 4-[2-(2-methylfuran-3-yl)-2-(propylamino)ethyl]pyridin-2-amine is CCCNC(Cc1ccnc(N)c1)c1ccoc1C.
What is the InChIKey of 4-[2-(2-methylfuran-3-yl)-2-(propylamino)ethyl]pyridin-2-amine?
The InChIKey is OYURKNVSBRZZOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-3-6-17-14(13-5-8-19-11(13)2)9-12-4-7-18-15(16)10-12/h4-5,7-8,10,14,17H,3,6,9H2,1-2H3,(H2,16,18).
What are the key properties of 4-[2-(2-methylfuran-3-yl)-2-(propylamino)ethyl]pyridin-2-amine?
4-[2-(2-methylfuran-3-yl)-2-(propylamino)ethyl]pyridin-2-amine has a molecular weight of 259.35 g/mol, XLogP of 2.85, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-methylfuran-3-yl)-2-(propylamino)ethyl]pyridin-2-amine is sourced from PubChem (CID 104790403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).