N-methyl-1-[2-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-3-yl]methanamine

C11H17N5 — CID 103015761

IUPACN-methyl-1-[2-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-3-yl]methanamine
SMILESCNCc1ccnn1CCc1ccnn1C
InChIInChI=1S/C11H17N5/c1-12-9-11-4-7-14-16(11)8-5-10-3-6-13-15(10)2/h3-4,6-7,12H,5,8-9H2,1-2H3
InChIKeyPJOQWFGQCJBJFL-UHFFFAOYSA-N
MW219.29 g/mol
LogP0.58
Rot. Bonds5

About N-methyl-1-[2-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-3-yl]methanamine

N-methyl-1-[2-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-3-yl]methanamine (PubChem CID 103015761) has the molecular formula C11H17N5 and a molecular weight of 219.29 g/mol. Its IUPAC name is N-methyl-1-[2-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-3-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[2-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-3-yl]methanamine
PubChem CID103015761
Molecular FormulaC11H17N5
Molecular Weight219.29 g/mol
Exact Mass219.15
IUPAC NameN-methyl-1-[2-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-3-yl]methanamine
SMILESCNCc1ccnn1CCc1ccnn1C
InChIInChI=1S/C11H17N5/c1-12-9-11-4-7-14-16(11)8-5-10-3-6-13-15(10)2/h3-4,6-7,12H,5,8-9H2,1-2H3
InChIKeyPJOQWFGQCJBJFL-UHFFFAOYSA-N
XLogP0.58
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-1-[3-[2-(2-methylpyrazol-3-yl)ethylsulfanyl]phenyl]methanamine
CID 103015658
N-[(2-methylpyrazol-3-yl)methyl]acetamide
CID 19292671
1-[2-(2-methylpyrazol-3-yl)ethyl]tetrazol-5-amine
CID 103012189
1-[2-chloro-6-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]-N-methylmethanamine
CID 102999897
N-methyl-5-(2-methylpyrazol-3-yl)-2-phenylpentan-1-amine
CID 103019984
N,4-dimethyl-2-[2-(2-methylpyrazol-3-yl)ethyl]pentan-1-amine
CID 103014306
1-[2-(cyclobutylmethyl)pyrazol-3-yl]-N-methylmethanamine
CID 84768012
4-(2-methylpyrazol-3-yl)butanal
CID 103014880
N,3,3-trimethyl-2-[2-(2-methylpyrazol-3-yl)ethyl]butan-1-amine
CID 103014774
1-[4-methoxy-3-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]-N-methylmethanamine
CID 102999612
N-methyl-2-[1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-4-yl]ethanamine
CID 103014178
N,2,2-trimethyl-6-(2-methylpyrazol-3-yl)hexan-3-amine
CID 103004349

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-3-yl]methanamine?
The IUPAC name of N-methyl-1-[2-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-3-yl]methanamine (CID 103015761) is N-methyl-1-[2-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-3-yl]methanamine.
What is the SMILES notation for N-methyl-1-[2-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-3-yl]methanamine?
The canonical SMILES for N-methyl-1-[2-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-3-yl]methanamine is CNCc1ccnn1CCc1ccnn1C.
What is the InChIKey of N-methyl-1-[2-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-3-yl]methanamine?
The InChIKey is PJOQWFGQCJBJFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5/c1-12-9-11-4-7-14-16(11)8-5-10-3-6-13-15(10)2/h3-4,6-7,12H,5,8-9H2,1-2H3.
What are the key properties of N-methyl-1-[2-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-3-yl]methanamine?
N-methyl-1-[2-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-3-yl]methanamine has a molecular weight of 219.29 g/mol, XLogP of 0.58, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-3-yl]methanamine is sourced from PubChem (CID 103015761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).