N-[2-(2-methylpyrazol-3-yl)ethyl]pentan-2-amine

C11H21N3 — CID 104695080

IUPACN-[2-(2-methylpyrazol-3-yl)ethyl]pentan-2-amine
SMILESCCCC(C)NCCc1ccnn1C
InChIInChI=1S/C11H21N3/c1-4-5-10(2)12-8-6-11-7-9-13-14(11)3/h7,9-10,12H,4-6,8H2,1-3H3
InChIKeyODEVLSYHXVUFQY-UHFFFAOYSA-N
MW195.31 g/mol
LogP1.74
Rot. Bonds6

About N-[2-(2-methylpyrazol-3-yl)ethyl]pentan-2-amine

N-[2-(2-methylpyrazol-3-yl)ethyl]pentan-2-amine (PubChem CID 104695080) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is N-[2-(2-methylpyrazol-3-yl)ethyl]pentan-2-amine.

Molecular Properties

Compound NameN-[2-(2-methylpyrazol-3-yl)ethyl]pentan-2-amine
PubChem CID104695080
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC NameN-[2-(2-methylpyrazol-3-yl)ethyl]pentan-2-amine
SMILESCCCC(C)NCCc1ccnn1C
InChIInChI=1S/C11H21N3/c1-4-5-10(2)12-8-6-11-7-9-13-14(11)3/h7,9-10,12H,4-6,8H2,1-3H3
InChIKeyODEVLSYHXVUFQY-UHFFFAOYSA-N
XLogP1.74
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-methylpyrazol-3-yl)ethyl]-4-phenylbutan-2-amine
CID 104693843
2-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pentan-3-amine
CID 104694997
N-[2-(2-methylpyrazol-3-yl)ethyl]heptan-3-amine
CID 104695096
N-[2-(2-methylpyrazol-3-yl)ethyl]-1-methylsulfinylpropan-2-amine
CID 103002139
N-[2-(2-methylpyrazol-3-yl)ethyl]-1-phenylethanamine
CID 113442203
N-[2-(2-methylpyrazol-3-yl)ethyl]-1-thiophen-2-ylpropan-2-amine
CID 113442346
3-ethyl-5-(2-methylpyrazol-3-yl)-N-propylpentan-2-amine
CID 103004378
6-methyl-1-(2-methylpyrazol-3-yl)-N-propylheptan-3-amine
CID 103009592
(1R)-1-(2,5-dimethylfuran-3-yl)-N-[2-(2-methylpyrazol-3-yl)ethyl]ethanamine
CID 100678259
1-cyclopropyl-N-[2-(2-methylpyrazol-3-yl)ethyl]propan-1-amine
CID 104695065
4-methoxy-1-(2-methylpyrazol-3-yl)-N-propylheptan-3-amine
CID 103012292
3-fluoro-4-[1-[2-(2-methylpyrazol-3-yl)ethylamino]ethyl]phenol
CID 107715491

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methylpyrazol-3-yl)ethyl]pentan-2-amine?
The IUPAC name of N-[2-(2-methylpyrazol-3-yl)ethyl]pentan-2-amine (CID 104695080) is N-[2-(2-methylpyrazol-3-yl)ethyl]pentan-2-amine.
What is the SMILES notation for N-[2-(2-methylpyrazol-3-yl)ethyl]pentan-2-amine?
The canonical SMILES for N-[2-(2-methylpyrazol-3-yl)ethyl]pentan-2-amine is CCCC(C)NCCc1ccnn1C.
What is the InChIKey of N-[2-(2-methylpyrazol-3-yl)ethyl]pentan-2-amine?
The InChIKey is ODEVLSYHXVUFQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-4-5-10(2)12-8-6-11-7-9-13-14(11)3/h7,9-10,12H,4-6,8H2,1-3H3.
What are the key properties of N-[2-(2-methylpyrazol-3-yl)ethyl]pentan-2-amine?
N-[2-(2-methylpyrazol-3-yl)ethyl]pentan-2-amine has a molecular weight of 195.31 g/mol, XLogP of 1.74, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methylpyrazol-3-yl)ethyl]pentan-2-amine is sourced from PubChem (CID 104695080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).