N-ethyl-5-[(3-propoxypiperidin-1-yl)methyl]pyrazin-2-amine

C15H26N4O — CID 103056216

IUPACN-ethyl-5-[(3-propoxypiperidin-1-yl)methyl]pyrazin-2-amine
SMILESCCCOC1CCCN(Cc2cnc(NCC)cn2)C1
InChIInChI=1S/C15H26N4O/c1-3-8-20-14-6-5-7-19(12-14)11-13-9-18-15(10-17-13)16-4-2/h9-10,14H,3-8,11-12H2,1-2H3,(H,16,18)
InChIKeyKWPVDAOSTHCSQH-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.30
Rot. Bonds7

About N-ethyl-5-[(3-propoxypiperidin-1-yl)methyl]pyrazin-2-amine

N-ethyl-5-[(3-propoxypiperidin-1-yl)methyl]pyrazin-2-amine (PubChem CID 103056216) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is N-ethyl-5-[(3-propoxypiperidin-1-yl)methyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-ethyl-5-[(3-propoxypiperidin-1-yl)methyl]pyrazin-2-amine
PubChem CID103056216
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC NameN-ethyl-5-[(3-propoxypiperidin-1-yl)methyl]pyrazin-2-amine
SMILESCCCOC1CCCN(Cc2cnc(NCC)cn2)C1
InChIInChI=1S/C15H26N4O/c1-3-8-20-14-6-5-7-19(12-14)11-13-9-18-15(10-17-13)16-4-2/h9-10,14H,3-8,11-12H2,1-2H3,(H,16,18)
InChIKeyKWPVDAOSTHCSQH-UHFFFAOYSA-N
XLogP2.30
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-5-(piperidin-1-ylmethyl)pyrazin-2-amine
CID 103055450
N-ethyl-5-[(4-propylazepan-1-yl)methyl]pyrazin-2-amine
CID 103056522
5-[(3-tert-butylpyrrolidin-1-yl)methyl]-N-ethylpyrazin-2-amine
CID 103056836
N-ethyl-5-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]pyrazin-2-amine
CID 103056396
5-[(3-ethoxypiperidin-1-yl)methyl]pyrazin-2-amine
CID 103056225
2-[1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidin-4-yl]oxyethanol
CID 103056751
methyl 1-[[5-(ethylamino)pyrazin-2-yl]methyl]pyrrolidine-3-carboxylate
CID 103056712
5-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-propylpyrazin-2-amine
CID 103056582
2-[1-[[5-(ethylamino)pyrazin-2-yl]methyl]pyrrolidin-3-yl]ethanol
CID 103056925
N-ethyl-5-[(2-methylpyrrolidin-1-yl)methyl]pyrazin-2-amine
CID 103055350
5-[(2,6-dimethylthiomorpholin-4-yl)methyl]-N-ethylpyrazin-2-amine
CID 103056506
2-[[5-(ethylamino)pyrazin-2-yl]methyl]-1,3,4,5,6,7,8,8a-octahydroisoquinolin-4a-ol
CID 103056725

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-[(3-propoxypiperidin-1-yl)methyl]pyrazin-2-amine?
The IUPAC name of N-ethyl-5-[(3-propoxypiperidin-1-yl)methyl]pyrazin-2-amine (CID 103056216) is N-ethyl-5-[(3-propoxypiperidin-1-yl)methyl]pyrazin-2-amine.
What is the SMILES notation for N-ethyl-5-[(3-propoxypiperidin-1-yl)methyl]pyrazin-2-amine?
The canonical SMILES for N-ethyl-5-[(3-propoxypiperidin-1-yl)methyl]pyrazin-2-amine is CCCOC1CCCN(Cc2cnc(NCC)cn2)C1.
What is the InChIKey of N-ethyl-5-[(3-propoxypiperidin-1-yl)methyl]pyrazin-2-amine?
The InChIKey is KWPVDAOSTHCSQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-3-8-20-14-6-5-7-19(12-14)11-13-9-18-15(10-17-13)16-4-2/h9-10,14H,3-8,11-12H2,1-2H3,(H,16,18).
What are the key properties of N-ethyl-5-[(3-propoxypiperidin-1-yl)methyl]pyrazin-2-amine?
N-ethyl-5-[(3-propoxypiperidin-1-yl)methyl]pyrazin-2-amine has a molecular weight of 278.40 g/mol, XLogP of 2.30, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-[(3-propoxypiperidin-1-yl)methyl]pyrazin-2-amine is sourced from PubChem (CID 103056216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).