N'-ethyl-N-methyl-1-pyridin-2-ylethane-1,2-diamine

C10H17N3 — CID 116950392

IUPACN'-ethyl-N-methyl-1-pyridin-2-ylethane-1,2-diamine
SMILESCCNCC(NC)c1ccccn1
InChIInChI=1S/C10H17N3/c1-3-12-8-10(11-2)9-6-4-5-7-13-9/h4-7,10-12H,3,8H2,1-2H3
InChIKeyQLLNIEOEPDOCEO-UHFFFAOYSA-N
MW179.27 g/mol
LogP0.95
Rot. Bonds5

About N'-ethyl-N-methyl-1-pyridin-2-ylethane-1,2-diamine

N'-ethyl-N-methyl-1-pyridin-2-ylethane-1,2-diamine (PubChem CID 116950392) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is N'-ethyl-N-methyl-1-pyridin-2-ylethane-1,2-diamine.

Molecular Properties

Compound NameN'-ethyl-N-methyl-1-pyridin-2-ylethane-1,2-diamine
PubChem CID116950392
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC NameN'-ethyl-N-methyl-1-pyridin-2-ylethane-1,2-diamine
SMILESCCNCC(NC)c1ccccn1
InChIInChI=1S/C10H17N3/c1-3-12-8-10(11-2)9-6-4-5-7-13-9/h4-7,10-12H,3,8H2,1-2H3
InChIKeyQLLNIEOEPDOCEO-UHFFFAOYSA-N
XLogP0.95
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethoxy-N-methyl-1-pyridin-2-ylpropan-1-amine
CID 114997349
N-methyl-3-methylsulfanyl-1-pyridin-2-ylpropan-1-amine
CID 116831660
N-ethyl-5-methyl-1-pyridin-2-ylhexan-1-amine
CID 83161018
N-methyl-4-phenoxy-1-pyridin-2-ylbutan-1-amine
CID 55155535
2-(3,4-dichlorophenyl)-N-methyl-1-pyridin-2-ylethanamine
CID 62601667
N-ethyl-1-pyridin-2-ylhexan-1-amine
CID 62600130
2-(5-bromo-2-pyridinyl)-N-methyl-1-pyridin-2-ylethanamine
CID 113454817
N-ethyl-4,4-dimethyl-1-pyridin-2-ylpentan-1-amine
CID 62602048
N-ethyl-3-methyl-1-pyridin-2-ylbut-3-en-1-amine
CID 79178919
N-ethyl-1-pyridin-2-ylnonan-1-amine
CID 62600129
2-cyclopropyl-N-ethyl-1-pyridin-2-ylethanamine
CID 64905890
(3-ethyl-1-pyridin-2-ylpentyl)hydrazine
CID 105195992

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N-methyl-1-pyridin-2-ylethane-1,2-diamine?
The IUPAC name of N'-ethyl-N-methyl-1-pyridin-2-ylethane-1,2-diamine (CID 116950392) is N'-ethyl-N-methyl-1-pyridin-2-ylethane-1,2-diamine.
What is the SMILES notation for N'-ethyl-N-methyl-1-pyridin-2-ylethane-1,2-diamine?
The canonical SMILES for N'-ethyl-N-methyl-1-pyridin-2-ylethane-1,2-diamine is CCNCC(NC)c1ccccn1.
What is the InChIKey of N'-ethyl-N-methyl-1-pyridin-2-ylethane-1,2-diamine?
The InChIKey is QLLNIEOEPDOCEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-3-12-8-10(11-2)9-6-4-5-7-13-9/h4-7,10-12H,3,8H2,1-2H3.
What are the key properties of N'-ethyl-N-methyl-1-pyridin-2-ylethane-1,2-diamine?
N'-ethyl-N-methyl-1-pyridin-2-ylethane-1,2-diamine has a molecular weight of 179.27 g/mol, XLogP of 0.95, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N-methyl-1-pyridin-2-ylethane-1,2-diamine is sourced from PubChem (CID 116950392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).