6-chloro-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine

C9H10ClN5 — CID 63294100

IUPAC6-chloro-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine
SMILESCn1ccnc1CNc1cncc(Cl)n1
InChIInChI=1S/C9H10ClN5/c1-15-3-2-12-9(15)6-13-8-5-11-4-7(10)14-8/h2-5H,6H2,1H3,(H,13,14)
InChIKeyQXIJAAOCYZXKOP-UHFFFAOYSA-N
MW223.67 g/mol
LogP1.48
Rot. Bonds3

About 6-chloro-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine

6-chloro-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine (PubChem CID 63294100) has the molecular formula C9H10ClN5 and a molecular weight of 223.67 g/mol. Its IUPAC name is 6-chloro-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine.

Molecular Properties

Compound Name6-chloro-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine
PubChem CID63294100
Molecular FormulaC9H10ClN5
Molecular Weight223.67 g/mol
Exact Mass223.06
IUPAC Name6-chloro-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine
SMILESCn1ccnc1CNc1cncc(Cl)n1
InChIInChI=1S/C9H10ClN5/c1-15-3-2-12-9(15)6-13-8-5-11-4-7(10)14-8/h2-5H,6H2,1H3,(H,13,14)
InChIKeyQXIJAAOCYZXKOP-UHFFFAOYSA-N
XLogP1.48
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.67
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-methoxy-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine
CID 155403130
6-chloro-2-ethyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine
CID 80936719
2-chloro-6-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine
CID 63294630
5-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine
CID 63295615
4-chloro-N-[(1-methylimidazol-2-yl)methyl]aniline
CID 43087975
2-N-methyl-6-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,6-diamine
CID 80829255
N-methyl-6-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine
CID 79737861
5-iodo-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine
CID 66342594
6-hydrazinyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine
CID 80913707
2-chloro-N-[(1-methylimidazol-2-yl)methyl]aniline
CID 43087854
4-methoxy-N-[(1-methylimidazol-2-yl)methyl]aniline
CID 43087956
4-methyl-2-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine
CID 79175761

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine?
The IUPAC name of 6-chloro-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine (CID 63294100) is 6-chloro-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine.
What is the SMILES notation for 6-chloro-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine?
The canonical SMILES for 6-chloro-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine is Cn1ccnc1CNc1cncc(Cl)n1.
What is the InChIKey of 6-chloro-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine?
The InChIKey is QXIJAAOCYZXKOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClN5/c1-15-3-2-12-9(15)6-13-8-5-11-4-7(10)14-8/h2-5H,6H2,1H3,(H,13,14).
What are the key properties of 6-chloro-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine?
6-chloro-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine has a molecular weight of 223.67 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine is sourced from PubChem (CID 63294100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).