6-chloro-N-[2-(oxan-2-yl)ethyl]pyrazin-2-amine

C11H16ClN3O — CID 103990689

IUPAC6-chloro-N-[2-(oxan-2-yl)ethyl]pyrazin-2-amine
SMILESClc1cncc(NCCC2CCCCO2)n1
InChIInChI=1S/C11H16ClN3O/c12-10-7-13-8-11(15-10)14-5-4-9-3-1-2-6-16-9/h7-9H,1-6H2,(H,14,15)
InChIKeySLESZNPRFJRVOH-UHFFFAOYSA-N
MW241.72 g/mol
LogP2.50
Rot. Bonds4

About 6-chloro-N-[2-(oxan-2-yl)ethyl]pyrazin-2-amine

6-chloro-N-[2-(oxan-2-yl)ethyl]pyrazin-2-amine (PubChem CID 103990689) has the molecular formula C11H16ClN3O and a molecular weight of 241.72 g/mol. Its IUPAC name is 6-chloro-N-[2-(oxan-2-yl)ethyl]pyrazin-2-amine.

Molecular Properties

Compound Name6-chloro-N-[2-(oxan-2-yl)ethyl]pyrazin-2-amine
PubChem CID103990689
Molecular FormulaC11H16ClN3O
Molecular Weight241.72 g/mol
Exact Mass241.10
IUPAC Name6-chloro-N-[2-(oxan-2-yl)ethyl]pyrazin-2-amine
SMILESClc1cncc(NCCC2CCCCO2)n1
InChIInChI=1S/C11H16ClN3O/c12-10-7-13-8-11(15-10)14-5-4-9-3-1-2-6-16-9/h7-9H,1-6H2,(H,14,15)
InChIKeySLESZNPRFJRVOH-UHFFFAOYSA-N
XLogP2.50
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.72
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-chloropyrazin-2-yl)-3-(oxan-2-yl)propanamide
CID 104819846
6-chloro-4-nitro-N-[2-(oxan-2-yl)ethyl]pyridin-2-amine
CID 103990720
2-chloro-N-[2-(oxolan-2-yl)ethyl]-1,3-thiazol-4-amine
CID 131134692
N-(6-chloropyrazin-2-yl)-2-(oxolan-2-yl)acetamide
CID 104819962
6-chloro-2-ethyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine
CID 80936355
6-chloro-4-nitro-N-[2-(oxolan-2-yl)ethyl]pyridin-2-amine
CID 103888346
5-bromo-N-[2-(oxan-2-yl)ethyl]pyrimidin-2-amine
CID 103990682
5-chloro-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine
CID 105369246
6-chloro-N-methyl-N-(oxan-2-ylmethyl)pyrazin-2-amine
CID 61362605
2-N-[2-(oxolan-2-yl)ethyl]pyrazine-2,5-diamine
CID 80652214
6-chloro-N-propylpyrazin-2-amine
CID 26370207
6-methoxy-N-[2-(oxolan-2-yl)ethyl]pyridin-2-amine
CID 63589868

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[2-(oxan-2-yl)ethyl]pyrazin-2-amine?
The IUPAC name of 6-chloro-N-[2-(oxan-2-yl)ethyl]pyrazin-2-amine (CID 103990689) is 6-chloro-N-[2-(oxan-2-yl)ethyl]pyrazin-2-amine.
What is the SMILES notation for 6-chloro-N-[2-(oxan-2-yl)ethyl]pyrazin-2-amine?
The canonical SMILES for 6-chloro-N-[2-(oxan-2-yl)ethyl]pyrazin-2-amine is Clc1cncc(NCCC2CCCCO2)n1.
What is the InChIKey of 6-chloro-N-[2-(oxan-2-yl)ethyl]pyrazin-2-amine?
The InChIKey is SLESZNPRFJRVOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3O/c12-10-7-13-8-11(15-10)14-5-4-9-3-1-2-6-16-9/h7-9H,1-6H2,(H,14,15).
What are the key properties of 6-chloro-N-[2-(oxan-2-yl)ethyl]pyrazin-2-amine?
6-chloro-N-[2-(oxan-2-yl)ethyl]pyrazin-2-amine has a molecular weight of 241.72 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[2-(oxan-2-yl)ethyl]pyrazin-2-amine is sourced from PubChem (CID 103990689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).