N-methyl-2-(4-methylpyrazol-1-yl)pentan-1-amine

C10H19N3 — CID 83046028

IUPACN-methyl-2-(4-methylpyrazol-1-yl)pentan-1-amine
SMILESCCCC(CNC)n1cc(C)cn1
InChIInChI=1S/C10H19N3/c1-4-5-10(7-11-3)13-8-9(2)6-12-13/h6,8,10-11H,4-5,7H2,1-3H3
InChIKeyAOASLAIGSXDEFD-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.75
Rot. Bonds5

About N-methyl-2-(4-methylpyrazol-1-yl)pentan-1-amine

N-methyl-2-(4-methylpyrazol-1-yl)pentan-1-amine (PubChem CID 83046028) has the molecular formula C10H19N3 and a molecular weight of 181.28 g/mol. Its IUPAC name is N-methyl-2-(4-methylpyrazol-1-yl)pentan-1-amine.

Molecular Properties

Compound NameN-methyl-2-(4-methylpyrazol-1-yl)pentan-1-amine
PubChem CID83046028
Molecular FormulaC10H19N3
Molecular Weight181.28 g/mol
Exact Mass181.16
IUPAC NameN-methyl-2-(4-methylpyrazol-1-yl)pentan-1-amine
SMILESCCCC(CNC)n1cc(C)cn1
InChIInChI=1S/C10H19N3/c1-4-5-10(7-11-3)13-8-9(2)6-12-13/h6,8,10-11H,4-5,7H2,1-3H3
InChIKeyAOASLAIGSXDEFD-UHFFFAOYSA-N
XLogP1.75
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(4-methylpyrazol-1-yl)pentan-1-amine?
The IUPAC name of N-methyl-2-(4-methylpyrazol-1-yl)pentan-1-amine (CID 83046028) is N-methyl-2-(4-methylpyrazol-1-yl)pentan-1-amine.
What is the SMILES notation for N-methyl-2-(4-methylpyrazol-1-yl)pentan-1-amine?
The canonical SMILES for N-methyl-2-(4-methylpyrazol-1-yl)pentan-1-amine is CCCC(CNC)n1cc(C)cn1.
What is the InChIKey of N-methyl-2-(4-methylpyrazol-1-yl)pentan-1-amine?
The InChIKey is AOASLAIGSXDEFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3/c1-4-5-10(7-11-3)13-8-9(2)6-12-13/h6,8,10-11H,4-5,7H2,1-3H3.
What are the key properties of N-methyl-2-(4-methylpyrazol-1-yl)pentan-1-amine?
N-methyl-2-(4-methylpyrazol-1-yl)pentan-1-amine has a molecular weight of 181.28 g/mol, XLogP of 1.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(4-methylpyrazol-1-yl)pentan-1-amine is sourced from PubChem (CID 83046028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).