N'-(3-fluoro-4-pyridinyl)ethane-1,2-diamine

C7H10FN3 — CID 112703774

IUPACN'-(3-fluoro-4-pyridinyl)ethane-1,2-diamine
SMILESNCCNc1ccncc1F
InChIInChI=1S/C7H10FN3/c8-6-5-10-3-1-7(6)11-4-2-9/h1,3,5H,2,4,9H2,(H,10,11)
InChIKeyYXYCFKVTIWIXGO-UHFFFAOYSA-N
MW155.18 g/mol
LogP0.59
Rot. Bonds3

About N'-(3-fluoro-4-pyridinyl)ethane-1,2-diamine

N'-(3-fluoro-4-pyridinyl)ethane-1,2-diamine (PubChem CID 112703774) has the molecular formula C7H10FN3 and a molecular weight of 155.18 g/mol. Its IUPAC name is N'-(3-fluoro-4-pyridinyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(3-fluoro-4-pyridinyl)ethane-1,2-diamine
PubChem CID112703774
Molecular FormulaC7H10FN3
Molecular Weight155.18 g/mol
Exact Mass155.09
IUPAC NameN'-(3-fluoro-4-pyridinyl)ethane-1,2-diamine
SMILESNCCNc1ccncc1F
InChIInChI=1S/C7H10FN3/c8-6-5-10-3-1-7(6)11-4-2-9/h1,3,5H,2,4,9H2,(H,10,11)
InChIKeyYXYCFKVTIWIXGO-UHFFFAOYSA-N
XLogP0.59
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.18
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N'-(3-fluoro-4-pyridinyl)ethane-1,2-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

methyl 4-(2-aminoethylamino)pyridine-3-carboxylate
CID 83830923
8-N-(2-aminoethyl)isoquinoline-5,8-diamine
CID 103138118
N'-(3-bromo-4-pyridinyl)propane-1,3-diamine
CID 104776647
3-fluoro-N-(oxolan-3-ylmethyl)pyridin-4-amine
CID 130678795
6-N,9-N-bis(2-aminoethyl)-5,10-dideuteriobenzo[g]isoquinoline-6,9-diamine
CID 172808417
[1-[[(3-fluoro-4-pyridinyl)amino]methyl]cyclopropyl]methanol
CID 164657514
N'-(3-bromo-4-pyridinyl)butane-1,4-diamine
CID 104776649
isoquinoline;N'-phenylethane-1,2-diamine
CID 67835553
3-fluoro-N-(3-indol-1-ylpropyl)pyridin-4-amine;hydrochloride
CID 68862206
3-(2-fluoroethylamino)pyridine-4-carbothioamide
CID 130504428
[1-[2-[(3-fluoro-4-pyridinyl)amino]ethyl]piperidin-2-yl]methanol
CID 134711273
N'-(4-methyl-3-pyridinyl)propane-1,3-diamine
CID 66273701

Frequently Asked Questions

What is the IUPAC name of N'-(3-fluoro-4-pyridinyl)ethane-1,2-diamine?
The IUPAC name of N'-(3-fluoro-4-pyridinyl)ethane-1,2-diamine (CID 112703774) is N'-(3-fluoro-4-pyridinyl)ethane-1,2-diamine.
What is the SMILES notation for N'-(3-fluoro-4-pyridinyl)ethane-1,2-diamine?
The canonical SMILES for N'-(3-fluoro-4-pyridinyl)ethane-1,2-diamine is NCCNc1ccncc1F.
What is the InChIKey of N'-(3-fluoro-4-pyridinyl)ethane-1,2-diamine?
The InChIKey is YXYCFKVTIWIXGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10FN3/c8-6-5-10-3-1-7(6)11-4-2-9/h1,3,5H,2,4,9H2,(H,10,11).
What are the key properties of N'-(3-fluoro-4-pyridinyl)ethane-1,2-diamine?
N'-(3-fluoro-4-pyridinyl)ethane-1,2-diamine has a molecular weight of 155.18 g/mol, XLogP of 0.59, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-fluoro-4-pyridinyl)ethane-1,2-diamine is sourced from PubChem (CID 112703774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).