N-methyl-1-[(1-methylpyrazol-3-yl)methyl]pyrrolidin-3-amine

C10H18N4 — CID 82869947

IUPACN-methyl-1-[(1-methylpyrazol-3-yl)methyl]pyrrolidin-3-amine
SMILESCNC1CCN(Cc2ccn(C)n2)C1
InChIInChI=1S/C10H18N4/c1-11-9-4-6-14(7-9)8-10-3-5-13(2)12-10/h3,5,9,11H,4,6-8H2,1-2H3
InChIKeyZQARCQMDLJWULQ-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.21
Rot. Bonds3

About N-methyl-1-[(1-methylpyrazol-3-yl)methyl]pyrrolidin-3-amine

N-methyl-1-[(1-methylpyrazol-3-yl)methyl]pyrrolidin-3-amine (PubChem CID 82869947) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is N-methyl-1-[(1-methylpyrazol-3-yl)methyl]pyrrolidin-3-amine.

Molecular Properties

Compound NameN-methyl-1-[(1-methylpyrazol-3-yl)methyl]pyrrolidin-3-amine
PubChem CID82869947
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC NameN-methyl-1-[(1-methylpyrazol-3-yl)methyl]pyrrolidin-3-amine
SMILESCNC1CCN(Cc2ccn(C)n2)C1
InChIInChI=1S/C10H18N4/c1-11-9-4-6-14(7-9)8-10-3-5-13(2)12-10/h3,5,9,11H,4,6-8H2,1-2H3
InChIKeyZQARCQMDLJWULQ-UHFFFAOYSA-N
XLogP0.21
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[(1-methylpyrazol-3-yl)methyl]pyrrolidin-3-amine?
The IUPAC name of N-methyl-1-[(1-methylpyrazol-3-yl)methyl]pyrrolidin-3-amine (CID 82869947) is N-methyl-1-[(1-methylpyrazol-3-yl)methyl]pyrrolidin-3-amine.
What is the SMILES notation for N-methyl-1-[(1-methylpyrazol-3-yl)methyl]pyrrolidin-3-amine?
The canonical SMILES for N-methyl-1-[(1-methylpyrazol-3-yl)methyl]pyrrolidin-3-amine is CNC1CCN(Cc2ccn(C)n2)C1.
What is the InChIKey of N-methyl-1-[(1-methylpyrazol-3-yl)methyl]pyrrolidin-3-amine?
The InChIKey is ZQARCQMDLJWULQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-11-9-4-6-14(7-9)8-10-3-5-13(2)12-10/h3,5,9,11H,4,6-8H2,1-2H3.
What are the key properties of N-methyl-1-[(1-methylpyrazol-3-yl)methyl]pyrrolidin-3-amine?
N-methyl-1-[(1-methylpyrazol-3-yl)methyl]pyrrolidin-3-amine has a molecular weight of 194.28 g/mol, XLogP of 0.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[(1-methylpyrazol-3-yl)methyl]pyrrolidin-3-amine is sourced from PubChem (CID 82869947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).