N-[[6-(4-methylpiperidin-1-yl)pyrazin-2-yl]methyl]propan-1-amine

C14H24N4 — CID 66458129

IUPACN-[[6-(4-methylpiperidin-1-yl)pyrazin-2-yl]methyl]propan-1-amine
SMILESCCCNCc1cncc(N2CCC(C)CC2)n1
InChIInChI=1S/C14H24N4/c1-3-6-15-9-13-10-16-11-14(17-13)18-7-4-12(2)5-8-18/h10-12,15H,3-9H2,1-2H3
InChIKeyAAQFHRREFCYSEY-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.21
Rot. Bonds5

About N-[[6-(4-methylpiperidin-1-yl)pyrazin-2-yl]methyl]propan-1-amine

N-[[6-(4-methylpiperidin-1-yl)pyrazin-2-yl]methyl]propan-1-amine (PubChem CID 66458129) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[[6-(4-methylpiperidin-1-yl)pyrazin-2-yl]methyl]propan-1-amine.

Molecular Properties

Compound NameN-[[6-(4-methylpiperidin-1-yl)pyrazin-2-yl]methyl]propan-1-amine
PubChem CID66458129
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC NameN-[[6-(4-methylpiperidin-1-yl)pyrazin-2-yl]methyl]propan-1-amine
SMILESCCCNCc1cncc(N2CCC(C)CC2)n1
InChIInChI=1S/C14H24N4/c1-3-6-15-9-13-10-16-11-14(17-13)18-7-4-12(2)5-8-18/h10-12,15H,3-9H2,1-2H3
InChIKeyAAQFHRREFCYSEY-UHFFFAOYSA-N
XLogP2.21
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 ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[[6-(4-methylazepan-1-yl)pyrazin-2-yl]methyl]ethanamine
CID 66449329
N-[[6-[4-(cyclopropylmethyl)piperazin-1-yl]pyrazin-2-yl]methyl]propan-1-amine
CID 66451855
2-methyl-N-[[6-(4-methylazepan-1-yl)pyrazin-2-yl]methyl]propan-1-amine
CID 66449530
N-[[6-(8-azaspiro[4.5]decan-8-yl)pyrazin-2-yl]methyl]propan-1-amine
CID 66451089
N-[[6-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyrazin-2-yl]methyl]propan-1-amine
CID 102886778
N-methyl-1-[6-(4-propan-2-ylazepan-1-yl)pyrazin-2-yl]methanamine
CID 66449940
N-[[6-(3-methoxy-3-methylpiperidin-1-yl)pyrazin-2-yl]methyl]propan-1-amine
CID 107395302
N-[[6-(4-ethoxypiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-1-amine
CID 66457429
N-[[6-(3-methoxypyrrolidin-1-yl)pyrazin-2-yl]methyl]ethanamine
CID 103539323
N-[[6-(2-propylimidazol-1-yl)pyrazin-2-yl]methyl]propan-1-amine
CID 66451540
N-methyl-1-[6-(4-propylpiperazin-1-yl)pyrazin-2-yl]methanamine
CID 66456780
5-(4-methylpiperidin-1-yl)-N-propyl-1,2,4-triazin-3-amine
CID 112938499

Frequently Asked Questions

What is the IUPAC name of N-[[6-(4-methylpiperidin-1-yl)pyrazin-2-yl]methyl]propan-1-amine?
The IUPAC name of N-[[6-(4-methylpiperidin-1-yl)pyrazin-2-yl]methyl]propan-1-amine (CID 66458129) is N-[[6-(4-methylpiperidin-1-yl)pyrazin-2-yl]methyl]propan-1-amine.
What is the SMILES notation for N-[[6-(4-methylpiperidin-1-yl)pyrazin-2-yl]methyl]propan-1-amine?
The canonical SMILES for N-[[6-(4-methylpiperidin-1-yl)pyrazin-2-yl]methyl]propan-1-amine is CCCNCc1cncc(N2CCC(C)CC2)n1.
What is the InChIKey of N-[[6-(4-methylpiperidin-1-yl)pyrazin-2-yl]methyl]propan-1-amine?
The InChIKey is AAQFHRREFCYSEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-3-6-15-9-13-10-16-11-14(17-13)18-7-4-12(2)5-8-18/h10-12,15H,3-9H2,1-2H3.
What are the key properties of N-[[6-(4-methylpiperidin-1-yl)pyrazin-2-yl]methyl]propan-1-amine?
N-[[6-(4-methylpiperidin-1-yl)pyrazin-2-yl]methyl]propan-1-amine has a molecular weight of 248.37 g/mol, XLogP of 2.21, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(4-methylpiperidin-1-yl)pyrazin-2-yl]methyl]propan-1-amine is sourced from PubChem (CID 66458129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).