N'-(6-ethoxy-2-pyridinyl)-N'-propan-2-ylethane-1,2-diamine

C12H21N3O — CID 63586844

IUPACN'-(6-ethoxy-2-pyridinyl)-N'-propan-2-ylethane-1,2-diamine
SMILESCCOc1cccc(N(CCN)C(C)C)n1
InChIInChI=1S/C12H21N3O/c1-4-16-12-7-5-6-11(14-12)15(9-8-13)10(2)3/h5-7,10H,4,8-9,13H2,1-3H3
InChIKeyZQRSXCSMQKASDN-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.65
Rot. Bonds6

About N'-(6-ethoxy-2-pyridinyl)-N'-propan-2-ylethane-1,2-diamine

N'-(6-ethoxy-2-pyridinyl)-N'-propan-2-ylethane-1,2-diamine (PubChem CID 63586844) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is N'-(6-ethoxy-2-pyridinyl)-N'-propan-2-ylethane-1,2-diamine.

Molecular Properties

Compound NameN'-(6-ethoxy-2-pyridinyl)-N'-propan-2-ylethane-1,2-diamine
PubChem CID63586844
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC NameN'-(6-ethoxy-2-pyridinyl)-N'-propan-2-ylethane-1,2-diamine
SMILESCCOc1cccc(N(CCN)C(C)C)n1
InChIInChI=1S/C12H21N3O/c1-4-16-12-7-5-6-11(14-12)15(9-8-13)10(2)3/h5-7,10H,4,8-9,13H2,1-3H3
InChIKeyZQRSXCSMQKASDN-UHFFFAOYSA-N
XLogP1.65
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N'-(6-ethoxy-2-pyridinyl)-N'-propan-2-ylethane-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

6-ethoxy-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyridin-2-amine
CID 79719565
N'-(6-ethoxy-2-pyridinyl)-N'-(4-fluorophenyl)propane-1,3-diamine
CID 63589833
N'-(6-ethoxy-2-pyridinyl)-N'-(3-fluorophenyl)propane-1,3-diamine
CID 63590009
ethyl 3-[(6-ethoxy-2-pyridinyl)-methylamino]propanoate
CID 63588358
N'-(5-methyl-2-pyridinyl)-N'-propan-2-ylethane-1,2-diamine
CID 62587286
6-chloro-N-propan-2-yl-N-propylpyridin-2-amine
CID 63588596
N'-(6-methoxy-2-pyridinyl)-N'-methylethane-1,2-diamine
CID 63590609
2-[butyl-(6-ethoxy-2-pyridinyl)amino]ethanol
CID 55212591
6-[ethyl(propan-2-yl)amino]pyridine-2-carbothioamide
CID 64589022
N'-[(6-ethoxy-2-pyridinyl)methyl]-N'-(2-phenylethyl)ethane-1,2-diamine
CID 120912540
3-[(6-ethoxy-2-pyridinyl)-ethylamino]-N'-hydroxypropanimidamide
CID 77002311
3-[(6-ethoxy-2-pyridinyl)-ethylamino]propanimidamide
CID 63590025

Frequently Asked Questions

What is the IUPAC name of N'-(6-ethoxy-2-pyridinyl)-N'-propan-2-ylethane-1,2-diamine?
The IUPAC name of N'-(6-ethoxy-2-pyridinyl)-N'-propan-2-ylethane-1,2-diamine (CID 63586844) is N'-(6-ethoxy-2-pyridinyl)-N'-propan-2-ylethane-1,2-diamine.
What is the SMILES notation for N'-(6-ethoxy-2-pyridinyl)-N'-propan-2-ylethane-1,2-diamine?
The canonical SMILES for N'-(6-ethoxy-2-pyridinyl)-N'-propan-2-ylethane-1,2-diamine is CCOc1cccc(N(CCN)C(C)C)n1.
What is the InChIKey of N'-(6-ethoxy-2-pyridinyl)-N'-propan-2-ylethane-1,2-diamine?
The InChIKey is ZQRSXCSMQKASDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-4-16-12-7-5-6-11(14-12)15(9-8-13)10(2)3/h5-7,10H,4,8-9,13H2,1-3H3.
What are the key properties of N'-(6-ethoxy-2-pyridinyl)-N'-propan-2-ylethane-1,2-diamine?
N'-(6-ethoxy-2-pyridinyl)-N'-propan-2-ylethane-1,2-diamine has a molecular weight of 223.32 g/mol, XLogP of 1.65, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(6-ethoxy-2-pyridinyl)-N'-propan-2-ylethane-1,2-diamine is sourced from PubChem (CID 63586844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).