N-(3-chloropyrazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine

C10H17ClN4O — CID 62849226

IUPACN-(3-chloropyrazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine
SMILESCOCCN(C)CCNc1nccnc1Cl
InChIInChI=1S/C10H17ClN4O/c1-15(7-8-16-2)6-5-14-10-9(11)12-3-4-13-10/h3-4H,5-8H2,1-2H3,(H,13,14)
InChIKeyKITXJLOJMWVQGC-UHFFFAOYSA-N
MW244.73 g/mol
LogP1.12
Rot. Bonds7

About N-(3-chloropyrazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine

N-(3-chloropyrazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine (PubChem CID 62849226) has the molecular formula C10H17ClN4O and a molecular weight of 244.73 g/mol. Its IUPAC name is N-(3-chloropyrazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine.

Molecular Properties

Compound NameN-(3-chloropyrazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine
PubChem CID62849226
Molecular FormulaC10H17ClN4O
Molecular Weight244.73 g/mol
Exact Mass244.11
IUPAC NameN-(3-chloropyrazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine
SMILESCOCCN(C)CCNc1nccnc1Cl
InChIInChI=1S/C10H17ClN4O/c1-15(7-8-16-2)6-5-14-10-9(11)12-3-4-13-10/h3-4H,5-8H2,1-2H3,(H,13,14)
InChIKeyKITXJLOJMWVQGC-UHFFFAOYSA-N
XLogP1.12
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.73
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,6-dichloro-1,2,4-triazin-5-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine
CID 81035370
N'-(2-methoxyethyl)-N'-methyl-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)ethane-1,2-diamine
CID 104731385
6-chloro-2-N-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80824728
4-N-[2-[2-methoxyethyl(methyl)amino]ethyl]-6-N-methyl-5-propylpyrimidine-4,6-diamine
CID 80825153
N'-(2-methoxyethyl)-N'-methyl-N-pyridin-4-ylethane-1,2-diamine
CID 62844188
3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1-(2-methylpropyl)pyrazin-2-one
CID 62929520
3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1-propylpyrazin-2-one
CID 55156809
N'-(2-methoxyethyl)-N'-methyl-N-(1,2,4-thiadiazol-5-yl)ethane-1,2-diamine
CID 65273687
4-N-[2-[2-methoxyethyl(methyl)amino]ethyl]-5-methylpyrimidine-2,4-diamine
CID 80825681
2-N-[2-[2-methoxyethyl(methyl)amino]ethyl]-5-methylpyridine-2,3-diamine
CID 66281077
ethyl 2-[2-[2-methoxyethyl(methyl)amino]ethylamino]pyridine-3-carboxylate
CID 62844186
6-N-ethyl-4-N-[2-[2-methoxyethyl(methyl)amino]ethyl]-5-propan-2-ylpyrimidine-4,6-diamine
CID 80804395

Frequently Asked Questions

What is the IUPAC name of N-(3-chloropyrazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine?
The IUPAC name of N-(3-chloropyrazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine (CID 62849226) is N-(3-chloropyrazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine.
What is the SMILES notation for N-(3-chloropyrazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine?
The canonical SMILES for N-(3-chloropyrazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine is COCCN(C)CCNc1nccnc1Cl.
What is the InChIKey of N-(3-chloropyrazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine?
The InChIKey is KITXJLOJMWVQGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17ClN4O/c1-15(7-8-16-2)6-5-14-10-9(11)12-3-4-13-10/h3-4H,5-8H2,1-2H3,(H,13,14).
What are the key properties of N-(3-chloropyrazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine?
N-(3-chloropyrazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine has a molecular weight of 244.73 g/mol, XLogP of 1.12, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloropyrazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine is sourced from PubChem (CID 62849226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).