5-[(cyclopropylamino)methyl]-N-ethyl-N-(pyridin-2-ylmethyl)pyrazin-2-amine

C16H21N5 — CID 107380589

IUPAC5-[(cyclopropylamino)methyl]-N-ethyl-N-(pyridin-2-ylmethyl)pyrazin-2-amine
SMILESCCN(Cc1ccccn1)c1cnc(CNC2CC2)cn1
InChIInChI=1S/C16H21N5/c1-2-21(12-14-5-3-4-8-17-14)16-11-19-15(10-20-16)9-18-13-6-7-13/h3-5,8,10-11,13,18H,2,6-7,9,12H2,1H3
InChIKeyDEKUGUUEMDSEHU-UHFFFAOYSA-N
MW283.38 g/mol
LogP2.15
Rot. Bonds7

About 5-[(cyclopropylamino)methyl]-N-ethyl-N-(pyridin-2-ylmethyl)pyrazin-2-amine

5-[(cyclopropylamino)methyl]-N-ethyl-N-(pyridin-2-ylmethyl)pyrazin-2-amine (PubChem CID 107380589) has the molecular formula C16H21N5 and a molecular weight of 283.38 g/mol. Its IUPAC name is 5-[(cyclopropylamino)methyl]-N-ethyl-N-(pyridin-2-ylmethyl)pyrazin-2-amine.

Molecular Properties

Compound Name5-[(cyclopropylamino)methyl]-N-ethyl-N-(pyridin-2-ylmethyl)pyrazin-2-amine
PubChem CID107380589
Molecular FormulaC16H21N5
Molecular Weight283.38 g/mol
Exact Mass283.18
IUPAC Name5-[(cyclopropylamino)methyl]-N-ethyl-N-(pyridin-2-ylmethyl)pyrazin-2-amine
SMILESCCN(Cc1ccccn1)c1cnc(CNC2CC2)cn1
InChIInChI=1S/C16H21N5/c1-2-21(12-14-5-3-4-8-17-14)16-11-19-15(10-20-16)9-18-13-6-7-13/h3-5,8,10-11,13,18H,2,6-7,9,12H2,1H3
InChIKeyDEKUGUUEMDSEHU-UHFFFAOYSA-N
XLogP2.15
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[(cyclopropylamino)methyl]-N-ethyl-N-(pyridin-2-ylmethyl)pyrazin-2-amine?
The IUPAC name of 5-[(cyclopropylamino)methyl]-N-ethyl-N-(pyridin-2-ylmethyl)pyrazin-2-amine (CID 107380589) is 5-[(cyclopropylamino)methyl]-N-ethyl-N-(pyridin-2-ylmethyl)pyrazin-2-amine.
What is the SMILES notation for 5-[(cyclopropylamino)methyl]-N-ethyl-N-(pyridin-2-ylmethyl)pyrazin-2-amine?
The canonical SMILES for 5-[(cyclopropylamino)methyl]-N-ethyl-N-(pyridin-2-ylmethyl)pyrazin-2-amine is CCN(Cc1ccccn1)c1cnc(CNC2CC2)cn1.
What is the InChIKey of 5-[(cyclopropylamino)methyl]-N-ethyl-N-(pyridin-2-ylmethyl)pyrazin-2-amine?
The InChIKey is DEKUGUUEMDSEHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5/c1-2-21(12-14-5-3-4-8-17-14)16-11-19-15(10-20-16)9-18-13-6-7-13/h3-5,8,10-11,13,18H,2,6-7,9,12H2,1H3.
What are the key properties of 5-[(cyclopropylamino)methyl]-N-ethyl-N-(pyridin-2-ylmethyl)pyrazin-2-amine?
5-[(cyclopropylamino)methyl]-N-ethyl-N-(pyridin-2-ylmethyl)pyrazin-2-amine has a molecular weight of 283.38 g/mol, XLogP of 2.15, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(cyclopropylamino)methyl]-N-ethyl-N-(pyridin-2-ylmethyl)pyrazin-2-amine is sourced from PubChem (CID 107380589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).