3-methoxy-2-N-(3-methoxy-2-pyridinyl)propane-1,2-diamine

C10H17N3O2 — CID 106181998

IUPAC3-methoxy-2-N-(3-methoxy-2-pyridinyl)propane-1,2-diamine
SMILESCOCC(CN)Nc1ncccc1OC
InChIInChI=1S/C10H17N3O2/c1-14-7-8(6-11)13-10-9(15-2)4-3-5-12-10/h3-5,8H,6-7,11H2,1-2H3,(H,12,13)
InChIKeySVHISOVRTUAZBJ-UHFFFAOYSA-N
MW211.27 g/mol
LogP0.48
Rot. Bonds6

About 3-methoxy-2-N-(3-methoxy-2-pyridinyl)propane-1,2-diamine

3-methoxy-2-N-(3-methoxy-2-pyridinyl)propane-1,2-diamine (PubChem CID 106181998) has the molecular formula C10H17N3O2 and a molecular weight of 211.27 g/mol. Its IUPAC name is 3-methoxy-2-N-(3-methoxy-2-pyridinyl)propane-1,2-diamine.

Molecular Properties

Compound Name3-methoxy-2-N-(3-methoxy-2-pyridinyl)propane-1,2-diamine
PubChem CID106181998
Molecular FormulaC10H17N3O2
Molecular Weight211.27 g/mol
Exact Mass211.13
IUPAC Name3-methoxy-2-N-(3-methoxy-2-pyridinyl)propane-1,2-diamine
SMILESCOCC(CN)Nc1ncccc1OC
InChIInChI=1S/C10H17N3O2/c1-14-7-8(6-11)13-10-9(15-2)4-3-5-12-10/h3-5,8H,6-7,11H2,1-2H3,(H,12,13)
InChIKeySVHISOVRTUAZBJ-UHFFFAOYSA-N
XLogP0.48
TPSA69.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.27
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-methoxy-2-N-(3-propoxy-2-pyridinyl)propane-1,2-diamine
CID 114155004
3-methoxy-N-(1-methoxybutan-2-yl)pyridin-2-amine
CID 115923094
3-methoxy-N-(1-methoxy-3-methylbutan-2-yl)pyridin-2-amine
CID 115923095
N-(3-methoxy-2-pyridinyl)-1-phenylethane-1,2-diamine
CID 113371369
N-(4-chloro-1-methoxybutan-2-yl)-3-ethoxypyridin-2-amine
CID 106154134
N-(1-methoxypentan-2-yl)-3-propan-2-yloxypyridin-2-amine
CID 113370944
N'-(3-methoxy-2-pyridinyl)-2-methylpentane-1,5-diamine
CID 106155329
N-(1-ethoxypropan-2-yl)-3-methoxypyridin-2-amine
CID 115923070
N'-(3-methoxy-2-pyridinyl)ethane-1,2-diamine
CID 83826958
3-methoxy-N-pentan-2-ylpyridin-2-amine
CID 115923066
3-methoxy-2-N-pyridin-4-ylpropane-1,2-diamine
CID 106182027
N-(1-chloro-3-methoxypropan-2-yl)-5-methoxyisoquinolin-1-amine
CID 114154936

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-N-(3-methoxy-2-pyridinyl)propane-1,2-diamine?
The IUPAC name of 3-methoxy-2-N-(3-methoxy-2-pyridinyl)propane-1,2-diamine (CID 106181998) is 3-methoxy-2-N-(3-methoxy-2-pyridinyl)propane-1,2-diamine.
What is the SMILES notation for 3-methoxy-2-N-(3-methoxy-2-pyridinyl)propane-1,2-diamine?
The canonical SMILES for 3-methoxy-2-N-(3-methoxy-2-pyridinyl)propane-1,2-diamine is COCC(CN)Nc1ncccc1OC.
What is the InChIKey of 3-methoxy-2-N-(3-methoxy-2-pyridinyl)propane-1,2-diamine?
The InChIKey is SVHISOVRTUAZBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-14-7-8(6-11)13-10-9(15-2)4-3-5-12-10/h3-5,8H,6-7,11H2,1-2H3,(H,12,13).
What are the key properties of 3-methoxy-2-N-(3-methoxy-2-pyridinyl)propane-1,2-diamine?
3-methoxy-2-N-(3-methoxy-2-pyridinyl)propane-1,2-diamine has a molecular weight of 211.27 g/mol, XLogP of 0.48, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-N-(3-methoxy-2-pyridinyl)propane-1,2-diamine is sourced from PubChem (CID 106181998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).