N-methyl-1-(5-methylpyrazin-2-yl)decan-1-amine

C16H29N3 — CID 105124065

IUPACN-methyl-1-(5-methylpyrazin-2-yl)decan-1-amine
SMILESCCCCCCCCCC(NC)c1cnc(C)cn1
InChIInChI=1S/C16H29N3/c1-4-5-6-7-8-9-10-11-15(17-3)16-13-18-14(2)12-19-16/h12-13,15,17H,4-11H2,1-3H3
InChIKeyMFUHLOPSHOYLCS-UHFFFAOYSA-N
MW263.43 g/mol
LogP4.19
Rot. Bonds10

About N-methyl-1-(5-methylpyrazin-2-yl)decan-1-amine

N-methyl-1-(5-methylpyrazin-2-yl)decan-1-amine (PubChem CID 105124065) has the molecular formula C16H29N3 and a molecular weight of 263.43 g/mol. Its IUPAC name is N-methyl-1-(5-methylpyrazin-2-yl)decan-1-amine.

Molecular Properties

Compound NameN-methyl-1-(5-methylpyrazin-2-yl)decan-1-amine
PubChem CID105124065
Molecular FormulaC16H29N3
Molecular Weight263.43 g/mol
Exact Mass263.24
IUPAC NameN-methyl-1-(5-methylpyrazin-2-yl)decan-1-amine
SMILESCCCCCCCCCC(NC)c1cnc(C)cn1
InChIInChI=1S/C16H29N3/c1-4-5-6-7-8-9-10-11-15(17-3)16-13-18-14(2)12-19-16/h12-13,15,17H,4-11H2,1-3H3
InChIKeyMFUHLOPSHOYLCS-UHFFFAOYSA-N
XLogP4.19
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.43
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-methyl-1-(5-methylpyrazin-2-yl)decan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-methylpyrazin-2-yl)decan-1-amine?
The IUPAC name of N-methyl-1-(5-methylpyrazin-2-yl)decan-1-amine (CID 105124065) is N-methyl-1-(5-methylpyrazin-2-yl)decan-1-amine.
What is the SMILES notation for N-methyl-1-(5-methylpyrazin-2-yl)decan-1-amine?
The canonical SMILES for N-methyl-1-(5-methylpyrazin-2-yl)decan-1-amine is CCCCCCCCCC(NC)c1cnc(C)cn1.
What is the InChIKey of N-methyl-1-(5-methylpyrazin-2-yl)decan-1-amine?
The InChIKey is MFUHLOPSHOYLCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3/c1-4-5-6-7-8-9-10-11-15(17-3)16-13-18-14(2)12-19-16/h12-13,15,17H,4-11H2,1-3H3.
What are the key properties of N-methyl-1-(5-methylpyrazin-2-yl)decan-1-amine?
N-methyl-1-(5-methylpyrazin-2-yl)decan-1-amine has a molecular weight of 263.43 g/mol, XLogP of 4.19, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-methylpyrazin-2-yl)decan-1-amine is sourced from PubChem (CID 105124065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).