6-chloro-N-(2-methylpentan-3-yl)pyrazin-2-amine

C10H16ClN3 — CID 61488509

IUPAC6-chloro-N-(2-methylpentan-3-yl)pyrazin-2-amine
SMILESCCC(Nc1cncc(Cl)n1)C(C)C
InChIInChI=1S/C10H16ClN3/c1-4-8(7(2)3)13-10-6-12-5-9(11)14-10/h5-8H,4H2,1-3H3,(H,13,14)
InChIKeyZQNWGRXOBVJGJD-UHFFFAOYSA-N
MW213.71 g/mol
LogP2.98
Rot. Bonds4

About 6-chloro-N-(2-methylpentan-3-yl)pyrazin-2-amine

6-chloro-N-(2-methylpentan-3-yl)pyrazin-2-amine (PubChem CID 61488509) has the molecular formula C10H16ClN3 and a molecular weight of 213.71 g/mol. Its IUPAC name is 6-chloro-N-(2-methylpentan-3-yl)pyrazin-2-amine.

Molecular Properties

Compound Name6-chloro-N-(2-methylpentan-3-yl)pyrazin-2-amine
PubChem CID61488509
Molecular FormulaC10H16ClN3
Molecular Weight213.71 g/mol
Exact Mass213.10
IUPAC Name6-chloro-N-(2-methylpentan-3-yl)pyrazin-2-amine
SMILESCCC(Nc1cncc(Cl)n1)C(C)C
InChIInChI=1S/C10H16ClN3/c1-4-8(7(2)3)13-10-6-12-5-9(11)14-10/h5-8H,4H2,1-3H3,(H,13,14)
InChIKeyZQNWGRXOBVJGJD-UHFFFAOYSA-N
XLogP2.98
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.71
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-(6-chloropyrazin-2-yl)-3-methylbutane-1,2-diamine
CID 116650856
6-chloro-N-(1-methoxy-3-methylbutan-2-yl)pyrazin-2-amine
CID 65047983
5,6-dimethyl-N-(2-methylpentan-3-yl)pyrazin-2-amine
CID 114475547
2-[(6-chloropyrazin-2-yl)amino]propanoic acid
CID 114335356
6-chloro-4-N-(2-methylpentan-3-yl)pyrimidine-2,4-diamine
CID 78971397
6-chloro-N-(1-cyclohexylpropyl)pyrazin-2-amine
CID 62406542
6-chloro-N-[1-(4-ethoxyphenyl)ethyl]pyrazin-2-amine
CID 47370476
6-chloro-N-propylpyrazin-2-amine
CID 26370207
6-chloro-N-(4-cyclopropylbutan-2-yl)pyrazin-2-amine
CID 133480425
6-chloro-N-methylpyrazin-2-amine
CID 26967011
N-[(1S)-1-(4-bromophenyl)ethyl]-6-chloropyrazin-2-amine
CID 58934266
3-methyl-2-[[6-(propylamino)pyrazin-2-yl]amino]butan-1-ol
CID 80848976

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2-methylpentan-3-yl)pyrazin-2-amine?
The IUPAC name of 6-chloro-N-(2-methylpentan-3-yl)pyrazin-2-amine (CID 61488509) is 6-chloro-N-(2-methylpentan-3-yl)pyrazin-2-amine.
What is the SMILES notation for 6-chloro-N-(2-methylpentan-3-yl)pyrazin-2-amine?
The canonical SMILES for 6-chloro-N-(2-methylpentan-3-yl)pyrazin-2-amine is CCC(Nc1cncc(Cl)n1)C(C)C.
What is the InChIKey of 6-chloro-N-(2-methylpentan-3-yl)pyrazin-2-amine?
The InChIKey is ZQNWGRXOBVJGJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16ClN3/c1-4-8(7(2)3)13-10-6-12-5-9(11)14-10/h5-8H,4H2,1-3H3,(H,13,14).
What are the key properties of 6-chloro-N-(2-methylpentan-3-yl)pyrazin-2-amine?
6-chloro-N-(2-methylpentan-3-yl)pyrazin-2-amine has a molecular weight of 213.71 g/mol, XLogP of 2.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2-methylpentan-3-yl)pyrazin-2-amine is sourced from PubChem (CID 61488509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).