N'-furo[3,2-c]pyridin-4-ylbutane-1,4-diamine

C11H15N3O — CID 106535053

IUPACN'-furo[3,2-c]pyridin-4-ylbutane-1,4-diamine
SMILESNCCCCNc1nccc2occc12
InChIInChI=1S/C11H15N3O/c12-5-1-2-6-13-11-9-4-8-15-10(9)3-7-14-11/h3-4,7-8H,1-2,5-6,12H2,(H,13,14)
InChIKeyAZPLMCSRJYSYEK-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.98
Rot. Bonds5

About N'-furo[3,2-c]pyridin-4-ylbutane-1,4-diamine

N'-furo[3,2-c]pyridin-4-ylbutane-1,4-diamine (PubChem CID 106535053) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is N'-furo[3,2-c]pyridin-4-ylbutane-1,4-diamine.

Molecular Properties

Compound NameN'-furo[3,2-c]pyridin-4-ylbutane-1,4-diamine
PubChem CID106535053
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC NameN'-furo[3,2-c]pyridin-4-ylbutane-1,4-diamine
SMILESNCCCCNc1nccc2occc12
InChIInChI=1S/C11H15N3O/c12-5-1-2-6-13-11-9-4-8-15-10(9)3-7-14-11/h3-4,7-8H,1-2,5-6,12H2,(H,13,14)
InChIKeyAZPLMCSRJYSYEK-UHFFFAOYSA-N
XLogP1.98
TPSA64.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-furo[3,2-c]pyridin-4-ylpropane-1,3-diamine
CID 106535052
N-[2-(2-aminoethoxy)ethyl]furo[3,2-c]pyridin-4-amine
CID 106535766
N-(3-ethoxypropyl)furo[3,2-c]pyridin-4-amine
CID 103702457
N-(3-methylsulfonylpropyl)furo[3,2-c]pyridin-4-amine
CID 102809398
N-(3-cyclopentylpropyl)furo[3,2-c]pyridin-4-amine
CID 103702592
N-(2-methoxyethyl)furo[3,2-c]pyridin-4-amine
CID 90356822
ethyl 4-(furo[3,2-c]pyridin-4-ylamino)butanoate
CID 106534889
N-[2-(4-aminophenoxy)ethyl]furo[3,2-c]pyridin-4-amine
CID 106535273
N'-furo[3,2-c]pyridin-4-yl-N-(pyridin-3-ylmethyl)propane-1,3-diamine
CID 106535281
N-(2-ethylsulfinylethyl)furo[3,2-c]pyridin-4-amine
CID 103703045
3-amino-4-(furo[3,2-c]pyridin-4-ylamino)butan-2-ol
CID 106535310
2-(furo[3,2-c]pyridin-4-ylamino)-N-methylethanesulfonamide
CID 114175347

Frequently Asked Questions

What is the IUPAC name of N'-furo[3,2-c]pyridin-4-ylbutane-1,4-diamine?
The IUPAC name of N'-furo[3,2-c]pyridin-4-ylbutane-1,4-diamine (CID 106535053) is N'-furo[3,2-c]pyridin-4-ylbutane-1,4-diamine.
What is the SMILES notation for N'-furo[3,2-c]pyridin-4-ylbutane-1,4-diamine?
The canonical SMILES for N'-furo[3,2-c]pyridin-4-ylbutane-1,4-diamine is NCCCCNc1nccc2occc12.
What is the InChIKey of N'-furo[3,2-c]pyridin-4-ylbutane-1,4-diamine?
The InChIKey is AZPLMCSRJYSYEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c12-5-1-2-6-13-11-9-4-8-15-10(9)3-7-14-11/h3-4,7-8H,1-2,5-6,12H2,(H,13,14).
What are the key properties of N'-furo[3,2-c]pyridin-4-ylbutane-1,4-diamine?
N'-furo[3,2-c]pyridin-4-ylbutane-1,4-diamine has a molecular weight of 205.26 g/mol, XLogP of 1.98, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-furo[3,2-c]pyridin-4-ylbutane-1,4-diamine is sourced from PubChem (CID 106535053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).