6-methoxy-2-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2,3-diamine

C13H17N3O2 — CID 113286476

IUPAC6-methoxy-2-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2,3-diamine
SMILESCOc1ccc(N)c(NC(C)c2ccc(C)o2)n1
InChIInChI=1S/C13H17N3O2/c1-8-4-6-11(18-8)9(2)15-13-10(14)5-7-12(16-13)17-3/h4-7,9H,14H2,1-3H3,(H,15,16)
InChIKeyZQVIKWRNPAAOGH-UHFFFAOYSA-N
MW247.30 g/mol
LogP2.75
Rot. Bonds4

About 6-methoxy-2-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2,3-diamine

6-methoxy-2-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2,3-diamine (PubChem CID 113286476) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is 6-methoxy-2-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2,3-diamine.

Molecular Properties

Compound Name6-methoxy-2-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2,3-diamine
PubChem CID113286476
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC Name6-methoxy-2-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2,3-diamine
SMILESCOc1ccc(N)c(NC(C)c2ccc(C)o2)n1
InChIInChI=1S/C13H17N3O2/c1-8-4-6-11(18-8)9(2)15-13-10(14)5-7-12(16-13)17-3/h4-7,9H,14H2,1-3H3,(H,15,16)
InChIKeyZQVIKWRNPAAOGH-UHFFFAOYSA-N
XLogP2.75
TPSA73.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-methoxy-2-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2,3-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-methoxy-2-N-propan-2-ylpyridine-2,3-diamine
CID 115320271
6-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2,3,6-triamine
CID 79828244
2-methyl-4-N-[1-(5-methylfuran-2-yl)ethyl]-1H-imidazole-4,5-diamine
CID 82237135
6-methoxy-5-methyl-N-[1-(5-methylfuran-2-yl)ethyl]pyrimidin-4-amine
CID 66327670
6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride
CID 22731600
2-[(3-amino-6-methoxy-2-pyridinyl)amino]-3-methoxypropan-1-ol
CID 106184124
6-methyl-4-N-[1-(5-methylfuran-2-yl)ethyl]pyrimidine-2,4-diamine
CID 112724390
6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridine-2,3-diamine
CID 115320544
6-methoxy-4-N-methyl-2-N-[1-(5-methylfuran-2-yl)ethyl]-1,3,5-triazine-2,4-diamine
CID 80800528
5-amino-4-[1-(5-methylfuran-2-yl)ethylamino]-1H-pyrimidin-6-one
CID 137016213
3-N-[1-(5-methylfuran-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine
CID 66275154
3,5,6-trichloro-N-[1-(5-methylfuran-2-yl)ethyl]pyridin-2-amine
CID 102750656

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2,3-diamine?
The IUPAC name of 6-methoxy-2-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2,3-diamine (CID 113286476) is 6-methoxy-2-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2,3-diamine.
What is the SMILES notation for 6-methoxy-2-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2,3-diamine?
The canonical SMILES for 6-methoxy-2-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2,3-diamine is COc1ccc(N)c(NC(C)c2ccc(C)o2)n1.
What is the InChIKey of 6-methoxy-2-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2,3-diamine?
The InChIKey is ZQVIKWRNPAAOGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2/c1-8-4-6-11(18-8)9(2)15-13-10(14)5-7-12(16-13)17-3/h4-7,9H,14H2,1-3H3,(H,15,16).
What are the key properties of 6-methoxy-2-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2,3-diamine?
6-methoxy-2-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2,3-diamine has a molecular weight of 247.30 g/mol, XLogP of 2.75, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2,3-diamine is sourced from PubChem (CID 113286476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).