2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]prop-2-en-1-amine

C10H17N3 — CID 106758152

IUPAC2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]prop-2-en-1-amine
SMILESC=C(C)CNC(C)c1ccnn1C
InChIInChI=1S/C10H17N3/c1-8(2)7-11-9(3)10-5-6-12-13(10)4/h5-6,9,11H,1,7H2,2-4H3
InChIKeyDAIGKEWMMGPNRF-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.65
Rot. Bonds4

About 2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]prop-2-en-1-amine

2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]prop-2-en-1-amine (PubChem CID 106758152) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]prop-2-en-1-amine.

Molecular Properties

Compound Name2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]prop-2-en-1-amine
PubChem CID106758152
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]prop-2-en-1-amine
SMILESC=C(C)CNC(C)c1ccnn1C
InChIInChI=1S/C10H17N3/c1-8(2)7-11-9(3)10-5-6-12-13(10)4/h5-6,9,11H,1,7H2,2-4H3
InChIKeyDAIGKEWMMGPNRF-UHFFFAOYSA-N
XLogP1.65
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]prop-2-en-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[1-(2-methylpyrazol-3-yl)ethylamino]-N-propan-2-ylacetamide
CID 106757076
N'-[1-(2-methylpyrazol-3-yl)ethyl]ethane-1,2-diamine
CID 66657947
N-benzyl-1-(2-methylpyrazol-3-yl)ethanamine
CID 106756794
2,2-difluoro-N-[1-(2-methylpyrazol-3-yl)ethyl]ethanamine
CID 106757996
2-ethyl-N-[1-(2-methylpyrazol-3-yl)ethyl]butan-1-amine
CID 106758131
3-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]pentan-3-ol
CID 106757861
3,3,3-trifluoro-N-[1-(2-methylpyrazol-3-yl)ethyl]propan-1-amine
CID 106757793
4-[1-(2-methylpyrazol-3-yl)ethylamino]butanamide
CID 106757536
1-[1-(2-methylpyrazol-3-yl)ethylamino]pentan-2-ol
CID 106758117
[1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclopropyl]methanol
CID 106757997
2,2-dimethyl-N-[1-(2-methylpyrazol-3-yl)ethyl]butan-1-amine
CID 106758170
(E)-N-[1-(2-methylpyrazol-3-yl)ethyl]pent-3-en-1-amine
CID 106758084

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]prop-2-en-1-amine?
The IUPAC name of 2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]prop-2-en-1-amine (CID 106758152) is 2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]prop-2-en-1-amine.
What is the SMILES notation for 2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]prop-2-en-1-amine?
The canonical SMILES for 2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]prop-2-en-1-amine is C=C(C)CNC(C)c1ccnn1C.
What is the InChIKey of 2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]prop-2-en-1-amine?
The InChIKey is DAIGKEWMMGPNRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-8(2)7-11-9(3)10-5-6-12-13(10)4/h5-6,9,11H,1,7H2,2-4H3.
What are the key properties of 2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]prop-2-en-1-amine?
2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]prop-2-en-1-amine has a molecular weight of 179.27 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]prop-2-en-1-amine is sourced from PubChem (CID 106758152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).