5-N-[2-(furan-2-yl)ethyl]-3-N-propylpyridine-3,5-diamine

C14H19N3O — CID 104533461

IUPAC5-N-[2-(furan-2-yl)ethyl]-3-N-propylpyridine-3,5-diamine
SMILESCCCNc1cncc(NCCc2ccco2)c1
InChIInChI=1S/C14H19N3O/c1-2-6-16-12-9-13(11-15-10-12)17-7-5-14-4-3-8-18-14/h3-4,8-11,16-17H,2,5-7H2,1H3
InChIKeyOJDCELIGRRBIQX-UHFFFAOYSA-N
MW245.33 g/mol
LogP3.15
Rot. Bonds7

About 5-N-[2-(furan-2-yl)ethyl]-3-N-propylpyridine-3,5-diamine

5-N-[2-(furan-2-yl)ethyl]-3-N-propylpyridine-3,5-diamine (PubChem CID 104533461) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 5-N-[2-(furan-2-yl)ethyl]-3-N-propylpyridine-3,5-diamine.

Molecular Properties

Compound Name5-N-[2-(furan-2-yl)ethyl]-3-N-propylpyridine-3,5-diamine
PubChem CID104533461
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name5-N-[2-(furan-2-yl)ethyl]-3-N-propylpyridine-3,5-diamine
SMILESCCCNc1cncc(NCCc2ccco2)c1
InChIInChI=1S/C14H19N3O/c1-2-6-16-12-9-13(11-15-10-12)17-7-5-14-4-3-8-18-14/h3-4,8-11,16-17H,2,5-7H2,1H3
InChIKeyOJDCELIGRRBIQX-UHFFFAOYSA-N
XLogP3.15
TPSA50.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-N-[2-(furan-2-yl)ethyl]pyridine-3,5-diamine
CID 104533462
3,5-dichloro-6-N-[2-(furan-2-yl)ethyl]-2-N-propylpyridine-2,6-diamine
CID 102756901
4-N-[2-(furan-2-yl)ethyl]-6-N,2-dipropylpyrimidine-4,6-diamine
CID 80941818
5-(furan-2-ylmethylamino)-N-propylpyridine-3-carboxamide
CID 109222782
4-N-[2-(furan-2-yl)ethyl]-2-N,2-N-dimethyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80781292
3-N-[2-(furan-2-yl)ethyl]benzene-1,3-diamine
CID 61469743
N-[2-(furan-2-yl)ethyl]-3-(propylamino)pyridine-4-carboxamide
CID 105069134
5-N-pentan-3-yl-3-N-propylpyridine-3,5-diamine
CID 104532563
6-(furan-2-ylmethoxy)-N-propylpyrazin-2-amine
CID 80858650
6-(furan-2-ylmethylsulfanyl)-N-propylpyrazin-2-amine
CID 80892831
3-N-propyl-5-N-(pyridin-4-ylmethyl)pyridine-3,5-diamine
CID 104532744
5-[2-(furan-2-yl)ethylamino]pyridine-2-carboxylic acid
CID 115490683

Frequently Asked Questions

What is the IUPAC name of 5-N-[2-(furan-2-yl)ethyl]-3-N-propylpyridine-3,5-diamine?
The IUPAC name of 5-N-[2-(furan-2-yl)ethyl]-3-N-propylpyridine-3,5-diamine (CID 104533461) is 5-N-[2-(furan-2-yl)ethyl]-3-N-propylpyridine-3,5-diamine.
What is the SMILES notation for 5-N-[2-(furan-2-yl)ethyl]-3-N-propylpyridine-3,5-diamine?
The canonical SMILES for 5-N-[2-(furan-2-yl)ethyl]-3-N-propylpyridine-3,5-diamine is CCCNc1cncc(NCCc2ccco2)c1.
What is the InChIKey of 5-N-[2-(furan-2-yl)ethyl]-3-N-propylpyridine-3,5-diamine?
The InChIKey is OJDCELIGRRBIQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-2-6-16-12-9-13(11-15-10-12)17-7-5-14-4-3-8-18-14/h3-4,8-11,16-17H,2,5-7H2,1H3.
What are the key properties of 5-N-[2-(furan-2-yl)ethyl]-3-N-propylpyridine-3,5-diamine?
5-N-[2-(furan-2-yl)ethyl]-3-N-propylpyridine-3,5-diamine has a molecular weight of 245.33 g/mol, XLogP of 3.15, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-[2-(furan-2-yl)ethyl]-3-N-propylpyridine-3,5-diamine is sourced from PubChem (CID 104533461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).