6-chloro-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrazin-2-amine

C14H15ClN4O — CID 86766846

IUPAC6-chloro-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrazin-2-amine
SMILESClc1cncc(Nc2ccc([C@@H]3CNCCO3)cc2)n1
InChIInChI=1S/C14H15ClN4O/c15-13-8-17-9-14(19-13)18-11-3-1-10(2-4-11)12-7-16-5-6-20-12/h1-4,8-9,12,16H,5-7H2,(H,18,19)/t12-/m0/s1
InChIKeyAMJLTHCNOFPOCQ-LBPRGKRZSA-N
MW290.75 g/mol
LogP2.53
Rot. Bonds3

About 6-chloro-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrazin-2-amine

6-chloro-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrazin-2-amine (PubChem CID 86766846) has the molecular formula C14H15ClN4O and a molecular weight of 290.75 g/mol. Its IUPAC name is 6-chloro-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrazin-2-amine.

Molecular Properties

Compound Name6-chloro-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrazin-2-amine
PubChem CID86766846
Molecular FormulaC14H15ClN4O
Molecular Weight290.75 g/mol
Exact Mass290.09
IUPAC Name6-chloro-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrazin-2-amine
SMILESClc1cncc(Nc2ccc([C@@H]3CNCCO3)cc2)n1
InChIInChI=1S/C14H15ClN4O/c15-13-8-17-9-14(19-13)18-11-3-1-10(2-4-11)12-7-16-5-6-20-12/h1-4,8-9,12,16H,5-7H2,(H,18,19)/t12-/m0/s1
InChIKeyAMJLTHCNOFPOCQ-LBPRGKRZSA-N
XLogP2.53
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrazin-2-amine?
The IUPAC name of 6-chloro-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrazin-2-amine (CID 86766846) is 6-chloro-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrazin-2-amine.
What is the SMILES notation for 6-chloro-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrazin-2-amine?
The canonical SMILES for 6-chloro-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrazin-2-amine is Clc1cncc(Nc2ccc([C@@H]3CNCCO3)cc2)n1.
What is the InChIKey of 6-chloro-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrazin-2-amine?
The InChIKey is AMJLTHCNOFPOCQ-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H15ClN4O/c15-13-8-17-9-14(19-13)18-11-3-1-10(2-4-11)12-7-16-5-6-20-12/h1-4,8-9,12,16H,5-7H2,(H,18,19)/t12-/m0/s1.
What are the key properties of 6-chloro-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrazin-2-amine?
6-chloro-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrazin-2-amine has a molecular weight of 290.75 g/mol, XLogP of 2.53, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrazin-2-amine is sourced from PubChem (CID 86766846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).