N-methyl-5-[(4-propylpiperidin-1-yl)methyl]pyrazin-2-amine

C14H24N4 — CID 103056267

IUPACN-methyl-5-[(4-propylpiperidin-1-yl)methyl]pyrazin-2-amine
SMILESCCCC1CCN(Cc2cnc(NC)cn2)CC1
InChIInChI=1S/C14H24N4/c1-3-4-12-5-7-18(8-6-12)11-13-9-17-14(15-2)10-16-13/h9-10,12H,3-8,11H2,1-2H3,(H,15,17)
InChIKeyZHMSPSLDIAFMQO-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.53
Rot. Bonds5

About N-methyl-5-[(4-propylpiperidin-1-yl)methyl]pyrazin-2-amine

N-methyl-5-[(4-propylpiperidin-1-yl)methyl]pyrazin-2-amine (PubChem CID 103056267) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is N-methyl-5-[(4-propylpiperidin-1-yl)methyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-methyl-5-[(4-propylpiperidin-1-yl)methyl]pyrazin-2-amine
PubChem CID103056267
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC NameN-methyl-5-[(4-propylpiperidin-1-yl)methyl]pyrazin-2-amine
SMILESCCCC1CCN(Cc2cnc(NC)cn2)CC1
InChIInChI=1S/C14H24N4/c1-3-4-12-5-7-18(8-6-12)11-13-9-17-14(15-2)10-16-13/h9-10,12H,3-8,11H2,1-2H3,(H,15,17)
InChIKeyZHMSPSLDIAFMQO-UHFFFAOYSA-N
XLogP2.53
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-5-[(4-propylpiperidin-1-yl)methyl]pyrazin-2-amine?
The IUPAC name of N-methyl-5-[(4-propylpiperidin-1-yl)methyl]pyrazin-2-amine (CID 103056267) is N-methyl-5-[(4-propylpiperidin-1-yl)methyl]pyrazin-2-amine.
What is the SMILES notation for N-methyl-5-[(4-propylpiperidin-1-yl)methyl]pyrazin-2-amine?
The canonical SMILES for N-methyl-5-[(4-propylpiperidin-1-yl)methyl]pyrazin-2-amine is CCCC1CCN(Cc2cnc(NC)cn2)CC1.
What is the InChIKey of N-methyl-5-[(4-propylpiperidin-1-yl)methyl]pyrazin-2-amine?
The InChIKey is ZHMSPSLDIAFMQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-3-4-12-5-7-18(8-6-12)11-13-9-17-14(15-2)10-16-13/h9-10,12H,3-8,11H2,1-2H3,(H,15,17).
What are the key properties of N-methyl-5-[(4-propylpiperidin-1-yl)methyl]pyrazin-2-amine?
N-methyl-5-[(4-propylpiperidin-1-yl)methyl]pyrazin-2-amine has a molecular weight of 248.37 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-[(4-propylpiperidin-1-yl)methyl]pyrazin-2-amine is sourced from PubChem (CID 103056267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).