N-(4-chloro-2-methylphenyl)pyrazin-2-amine

C11H10ClN3 — CID 118286926

IUPACN-(4-chloro-2-methylphenyl)pyrazin-2-amine
SMILESCc1cc(Cl)ccc1Nc1cnccn1
InChIInChI=1S/C11H10ClN3/c1-8-6-9(12)2-3-10(8)15-11-7-13-4-5-14-11/h2-7H,1H3,(H,14,15)
InChIKeyBRSCMIOJXUYJFF-UHFFFAOYSA-N
MW219.68 g/mol
LogP3.18
Rot. Bonds2

About N-(4-chloro-2-methylphenyl)pyrazin-2-amine

N-(4-chloro-2-methylphenyl)pyrazin-2-amine (PubChem CID 118286926) has the molecular formula C11H10ClN3 and a molecular weight of 219.68 g/mol. Its IUPAC name is N-(4-chloro-2-methylphenyl)pyrazin-2-amine.

Molecular Properties

Compound NameN-(4-chloro-2-methylphenyl)pyrazin-2-amine
PubChem CID118286926
Molecular FormulaC11H10ClN3
Molecular Weight219.68 g/mol
Exact Mass219.06
IUPAC NameN-(4-chloro-2-methylphenyl)pyrazin-2-amine
SMILESCc1cc(Cl)ccc1Nc1cnccn1
InChIInChI=1S/C11H10ClN3/c1-8-6-9(12)2-3-10(8)15-11-7-13-4-5-14-11/h2-7H,1H3,(H,14,15)
InChIKeyBRSCMIOJXUYJFF-UHFFFAOYSA-N
XLogP3.18
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.68
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-(4-chloro-2-methylphenyl)pyrazine-2,6-diamine
CID 80648132
5-(aminomethyl)-N-(4-chloro-2-methylphenyl)pyridin-2-amine
CID 82296151
2-N-(4-chloro-2-methylphenyl)pyrimidine-2,5-diamine
CID 82290977
5-(4-chloro-2-methylanilino)-N-(4-chlorophenyl)pyrazine-2-carboxamide
CID 109292823
2,4-dimethyl-N-pyrazin-2-ylpyrimidin-5-amine
CID 153337877
2-(4-chloro-2-methylanilino)-N-(pyridin-4-ylmethyl)pyridine-4-carboxamide
CID 109172024
4-N-(4-chloro-2-methylphenyl)-6-N-methylpyrimidine-2,4,6-triamine
CID 114256694
4-N-(4-chloro-2-methylphenyl)-6-methyl-2-N-(pyridin-4-ylmethyl)pyrimidine-2,4-diamine
CID 112919954
4-N-(4-chloro-2-methylphenyl)-2-methyl-6-N-(pyridin-4-ylmethyl)pyrimidine-4,6-diamine
CID 112873603
2-N-(4-chloro-2-methylphenyl)-4-N-(2,3,4-trifluorophenyl)pyrimidine-2,4-diamine
CID 112904048
N-(4-chloro-2-methylphenyl)-4-methoxy-2-methylaniline
CID 139611066
6-(4-chloro-2-methylanilino)-N,N-di(propan-2-yl)pyridine-3-sulfonamide
CID 5267817

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methylphenyl)pyrazin-2-amine?
The IUPAC name of N-(4-chloro-2-methylphenyl)pyrazin-2-amine (CID 118286926) is N-(4-chloro-2-methylphenyl)pyrazin-2-amine.
What is the SMILES notation for N-(4-chloro-2-methylphenyl)pyrazin-2-amine?
The canonical SMILES for N-(4-chloro-2-methylphenyl)pyrazin-2-amine is Cc1cc(Cl)ccc1Nc1cnccn1.
What is the InChIKey of N-(4-chloro-2-methylphenyl)pyrazin-2-amine?
The InChIKey is BRSCMIOJXUYJFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN3/c1-8-6-9(12)2-3-10(8)15-11-7-13-4-5-14-11/h2-7H,1H3,(H,14,15).
What are the key properties of N-(4-chloro-2-methylphenyl)pyrazin-2-amine?
N-(4-chloro-2-methylphenyl)pyrazin-2-amine has a molecular weight of 219.68 g/mol, XLogP of 3.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methylphenyl)pyrazin-2-amine is sourced from PubChem (CID 118286926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).