5-N-[1-(2,5-dimethylfuran-3-yl)ethyl]-2-N,2-N-diethylpyridine-2,5-diamine

C17H25N3O — CID 43697556

IUPAC5-N-[1-(2,5-dimethylfuran-3-yl)ethyl]-2-N,2-N-diethylpyridine-2,5-diamine
SMILESCCN(CC)c1ccc(NC(C)c2cc(C)oc2C)cn1
InChIInChI=1S/C17H25N3O/c1-6-20(7-2)17-9-8-15(11-18-17)19-13(4)16-10-12(3)21-14(16)5/h8-11,13,19H,6-7H2,1-5H3
InChIKeyHYVXDYZQKYQIHE-UHFFFAOYSA-N
MW287.41 g/mol
LogP4.31
Rot. Bonds6

About 5-N-[1-(2,5-dimethylfuran-3-yl)ethyl]-2-N,2-N-diethylpyridine-2,5-diamine

5-N-[1-(2,5-dimethylfuran-3-yl)ethyl]-2-N,2-N-diethylpyridine-2,5-diamine (PubChem CID 43697556) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is 5-N-[1-(2,5-dimethylfuran-3-yl)ethyl]-2-N,2-N-diethylpyridine-2,5-diamine.

Molecular Properties

Compound Name5-N-[1-(2,5-dimethylfuran-3-yl)ethyl]-2-N,2-N-diethylpyridine-2,5-diamine
PubChem CID43697556
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC Name5-N-[1-(2,5-dimethylfuran-3-yl)ethyl]-2-N,2-N-diethylpyridine-2,5-diamine
SMILESCCN(CC)c1ccc(NC(C)c2cc(C)oc2C)cn1
InChIInChI=1S/C17H25N3O/c1-6-20(7-2)17-9-8-15(11-18-17)19-13(4)16-10-12(3)21-14(16)5/h8-11,13,19H,6-7H2,1-5H3
InChIKeyHYVXDYZQKYQIHE-UHFFFAOYSA-N
XLogP4.31
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-N,2-N-diethyl-5-N-[1-(2-methylphenyl)ethyl]pyridine-2,5-diamine
CID 43697435
N-[1-(2,5-dimethylfuran-3-yl)ethyl]-6-methoxypyridin-3-amine
CID 43121192
N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-fluoroaniline
CID 43121304
N-[1-(2,5-dimethylfuran-3-yl)ethyl]-6-(2-methoxyethoxy)pyridin-3-amine
CID 43688441
4-[(dimethylamino)methyl]-N-[1-(2,5-dimethylfuran-3-yl)ethyl]aniline
CID 43747364
5-N-[1-(2,5-dimethylfuran-3-yl)ethyl]-3-N-methylpyridine-3,5-diamine
CID 104533947
N-[1-(2,5-dimethylfuran-3-yl)ethyl]-1H-indazol-5-amine
CID 43691017
5-bromo-N-[1-(2,5-dimethylfuran-3-yl)ethyl]pyridin-3-amine
CID 112690448
N-[1-(2,5-dimethylfuran-3-yl)ethyl]-5-(ethylamino)pyridine-2-carboxamide
CID 104640844
4-[1-(2,5-dimethylfuran-3-yl)ethylamino]-N,N-dimethylbenzamide
CID 43682035
2-N,2-N-diethyl-5-N-(2-methylpentyl)pyridine-2,5-diamine
CID 43697114
5-N-(cyclopropylmethyl)-2-N,2-N-diethylpyridine-2,5-diamine
CID 43697513

Frequently Asked Questions

What is the IUPAC name of 5-N-[1-(2,5-dimethylfuran-3-yl)ethyl]-2-N,2-N-diethylpyridine-2,5-diamine?
The IUPAC name of 5-N-[1-(2,5-dimethylfuran-3-yl)ethyl]-2-N,2-N-diethylpyridine-2,5-diamine (CID 43697556) is 5-N-[1-(2,5-dimethylfuran-3-yl)ethyl]-2-N,2-N-diethylpyridine-2,5-diamine.
What is the SMILES notation for 5-N-[1-(2,5-dimethylfuran-3-yl)ethyl]-2-N,2-N-diethylpyridine-2,5-diamine?
The canonical SMILES for 5-N-[1-(2,5-dimethylfuran-3-yl)ethyl]-2-N,2-N-diethylpyridine-2,5-diamine is CCN(CC)c1ccc(NC(C)c2cc(C)oc2C)cn1.
What is the InChIKey of 5-N-[1-(2,5-dimethylfuran-3-yl)ethyl]-2-N,2-N-diethylpyridine-2,5-diamine?
The InChIKey is HYVXDYZQKYQIHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c1-6-20(7-2)17-9-8-15(11-18-17)19-13(4)16-10-12(3)21-14(16)5/h8-11,13,19H,6-7H2,1-5H3.
What are the key properties of 5-N-[1-(2,5-dimethylfuran-3-yl)ethyl]-2-N,2-N-diethylpyridine-2,5-diamine?
5-N-[1-(2,5-dimethylfuran-3-yl)ethyl]-2-N,2-N-diethylpyridine-2,5-diamine has a molecular weight of 287.41 g/mol, XLogP of 4.31, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-[1-(2,5-dimethylfuran-3-yl)ethyl]-2-N,2-N-diethylpyridine-2,5-diamine is sourced from PubChem (CID 43697556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).