2-N-ethyl-6-N-(4-methoxybutan-2-yl)pyridine-2,6-diamine

C12H21N3O — CID 80843613

IUPAC2-N-ethyl-6-N-(4-methoxybutan-2-yl)pyridine-2,6-diamine
SMILESCCNc1cccc(NC(C)CCOC)n1
InChIInChI=1S/C12H21N3O/c1-4-13-11-6-5-7-12(15-11)14-10(2)8-9-16-3/h5-7,10H,4,8-9H2,1-3H3,(H2,13,14,15)
InChIKeyPSGPENAXQMLRHX-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.35
Rot. Bonds7

About 2-N-ethyl-6-N-(4-methoxybutan-2-yl)pyridine-2,6-diamine

2-N-ethyl-6-N-(4-methoxybutan-2-yl)pyridine-2,6-diamine (PubChem CID 80843613) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is 2-N-ethyl-6-N-(4-methoxybutan-2-yl)pyridine-2,6-diamine.

Molecular Properties

Compound Name2-N-ethyl-6-N-(4-methoxybutan-2-yl)pyridine-2,6-diamine
PubChem CID80843613
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name2-N-ethyl-6-N-(4-methoxybutan-2-yl)pyridine-2,6-diamine
SMILESCCNc1cccc(NC(C)CCOC)n1
InChIInChI=1S/C12H21N3O/c1-4-13-11-6-5-7-12(15-11)14-10(2)8-9-16-3/h5-7,10H,4,8-9H2,1-3H3,(H2,13,14,15)
InChIKeyPSGPENAXQMLRHX-UHFFFAOYSA-N
XLogP2.35
TPSA46.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-N-ethyl-2-N-(4-methoxybutan-2-yl)pyrazine-2,6-diamine
CID 78916118
2-N-ethyl-6-N-(6-methylheptan-2-yl)pyridine-2,6-diamine
CID 80800465
6-fluoro-N-(4-methoxybutan-2-yl)pyridin-2-amine
CID 62735334
6-(ethylamino)-N-(4-methoxybutan-2-yl)pyridine-2-carboxamide
CID 64604327
N-(4-methoxybutan-2-yl)-6-(trifluoromethyl)pyridin-2-amine
CID 62735148
2-N-ethyl-6-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-2,6-diamine
CID 80824062
N-ethyl-6-[[1-methoxypropan-2-yl(methyl)amino]methyl]pyridin-2-amine
CID 79243357
N-ethyl-6-[[2-methoxyethyl(propan-2-yl)amino]methyl]pyridin-2-amine
CID 82953078
6-N-heptan-2-yl-2-N-propylpyridine-2,6-diamine
CID 80803403
2-N-ethyl-6-N-[2-(3-methylbutoxy)ethyl]pyridine-2,6-diamine
CID 80820194
methyl 2-[[6-(ethylamino)-2-pyridinyl]amino]-4-methylpentanoate
CID 80812300
2-N-ethyl-6-N-[2-[2-methoxyethyl(methyl)amino]ethyl]pyridine-2,6-diamine
CID 80824639

Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-6-N-(4-methoxybutan-2-yl)pyridine-2,6-diamine?
The IUPAC name of 2-N-ethyl-6-N-(4-methoxybutan-2-yl)pyridine-2,6-diamine (CID 80843613) is 2-N-ethyl-6-N-(4-methoxybutan-2-yl)pyridine-2,6-diamine.
What is the SMILES notation for 2-N-ethyl-6-N-(4-methoxybutan-2-yl)pyridine-2,6-diamine?
The canonical SMILES for 2-N-ethyl-6-N-(4-methoxybutan-2-yl)pyridine-2,6-diamine is CCNc1cccc(NC(C)CCOC)n1.
What is the InChIKey of 2-N-ethyl-6-N-(4-methoxybutan-2-yl)pyridine-2,6-diamine?
The InChIKey is PSGPENAXQMLRHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-4-13-11-6-5-7-12(15-11)14-10(2)8-9-16-3/h5-7,10H,4,8-9H2,1-3H3,(H2,13,14,15).
What are the key properties of 2-N-ethyl-6-N-(4-methoxybutan-2-yl)pyridine-2,6-diamine?
2-N-ethyl-6-N-(4-methoxybutan-2-yl)pyridine-2,6-diamine has a molecular weight of 223.32 g/mol, XLogP of 2.35, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-6-N-(4-methoxybutan-2-yl)pyridine-2,6-diamine is sourced from PubChem (CID 80843613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).