N-ethyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]ethanamine

C10H19N3 — CID 786812

IUPACN-ethyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]ethanamine
SMILESCCc1cc(CN(CC)CC)[nH]n1
InChIInChI=1S/C10H19N3/c1-4-9-7-10(12-11-9)8-13(5-2)6-3/h7H,4-6,8H2,1-3H3,(H,11,12)
InChIKeyWALKAYMHDQCIKO-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.81
Rot. Bonds5

About N-ethyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]ethanamine

N-ethyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]ethanamine (PubChem CID 786812) has the molecular formula C10H19N3 and a molecular weight of 181.28 g/mol. Its IUPAC name is N-ethyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-ethyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]ethanamine
PubChem CID786812
Molecular FormulaC10H19N3
Molecular Weight181.28 g/mol
Exact Mass181.16
IUPAC NameN-ethyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]ethanamine
SMILESCCc1cc(CN(CC)CC)[nH]n1
InChIInChI=1S/C10H19N3/c1-4-9-7-10(12-11-9)8-13(5-2)6-3/h7H,4-6,8H2,1-3H3,(H,11,12)
InChIKeyWALKAYMHDQCIKO-UHFFFAOYSA-N
XLogP1.81
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]ethanamine 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-ethyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]ethanamine?
The IUPAC name of N-ethyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]ethanamine (CID 786812) is N-ethyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]ethanamine.
What is the SMILES notation for N-ethyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]ethanamine?
The canonical SMILES for N-ethyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]ethanamine is CCc1cc(CN(CC)CC)[nH]n1.
What is the InChIKey of N-ethyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]ethanamine?
The InChIKey is WALKAYMHDQCIKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3/c1-4-9-7-10(12-11-9)8-13(5-2)6-3/h7H,4-6,8H2,1-3H3,(H,11,12).
What are the key properties of N-ethyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]ethanamine?
N-ethyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]ethanamine has a molecular weight of 181.28 g/mol, XLogP of 1.81, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]ethanamine is sourced from PubChem (CID 786812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).