1-(3-methyltriazol-4-yl)-2-pyrrolidin-1-ylethanamine

C9H17N5 — CID 130730117

IUPAC1-(3-methyltriazol-4-yl)-2-pyrrolidin-1-ylethanamine
SMILESCn1nncc1C(N)CN1CCCC1
InChIInChI=1S/C9H17N5/c1-13-9(6-11-12-13)8(10)7-14-4-2-3-5-14/h6,8H,2-5,7,10H2,1H3
InChIKeyIVNSZHAVRKMVLK-UHFFFAOYSA-N
MW195.27 g/mol
LogP-0.09
Rot. Bonds3

About 1-(3-methyltriazol-4-yl)-2-pyrrolidin-1-ylethanamine

1-(3-methyltriazol-4-yl)-2-pyrrolidin-1-ylethanamine (PubChem CID 130730117) has the molecular formula C9H17N5 and a molecular weight of 195.27 g/mol. Its IUPAC name is 1-(3-methyltriazol-4-yl)-2-pyrrolidin-1-ylethanamine.

Molecular Properties

Compound Name1-(3-methyltriazol-4-yl)-2-pyrrolidin-1-ylethanamine
PubChem CID130730117
Molecular FormulaC9H17N5
Molecular Weight195.27 g/mol
Exact Mass195.15
IUPAC Name1-(3-methyltriazol-4-yl)-2-pyrrolidin-1-ylethanamine
SMILESCn1nncc1C(N)CN1CCCC1
InChIInChI=1S/C9H17N5/c1-13-9(6-11-12-13)8(10)7-14-4-2-3-5-14/h6,8H,2-5,7,10H2,1H3
InChIKeyIVNSZHAVRKMVLK-UHFFFAOYSA-N
XLogP-0.09
TPSA59.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 5-0.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(3-methyltriazol-4-yl)-2-pyrrolidin-1-ylethanamine 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-(azetidin-1-yl)-1-(3-methyltriazol-4-yl)ethanamine
CID 131011065
3-methyl-1-(3-methyltriazol-4-yl)butan-1-amine
CID 114686985
1-(3-methyltriazol-4-yl)-3-(oxolan-2-yl)propan-1-amine
CID 105043604
2-(azetidin-1-yl)-1-(4-methyl-3-pyridinyl)ethanamine
CID 130699391
2-(azetidin-1-yl)-1-(5-bromo-3-methyltriazol-4-yl)ethanamine
CID 127002795
2-amino-1-(3-methyltriazol-4-yl)ethanol
CID 114685353
1-(3-methyltriazol-4-yl)-2-propylpentan-1-amine
CID 105043778
2-piperidin-1-yl-1-(2,4,5-trimethylphenyl)ethanamine
CID 82295585
2-ethyl-1-(3-methyltriazol-4-yl)-N-propyl-2-pyrrolidin-1-ylbutan-1-amine
CID 114688377
2-(azepan-1-yl)-1-(2-methylphenyl)ethanamine
CID 16787615
2-pyrrolidin-1-yl-1-(1,3-thiazol-5-yl)ethanamine
CID 82398617
1-(4-propan-2-ylphenyl)-2-pyrrolidin-1-ylethanamine
CID 16643528

Frequently Asked Questions

What is the IUPAC name of 1-(3-methyltriazol-4-yl)-2-pyrrolidin-1-ylethanamine?
The IUPAC name of 1-(3-methyltriazol-4-yl)-2-pyrrolidin-1-ylethanamine (CID 130730117) is 1-(3-methyltriazol-4-yl)-2-pyrrolidin-1-ylethanamine.
What is the SMILES notation for 1-(3-methyltriazol-4-yl)-2-pyrrolidin-1-ylethanamine?
The canonical SMILES for 1-(3-methyltriazol-4-yl)-2-pyrrolidin-1-ylethanamine is Cn1nncc1C(N)CN1CCCC1.
What is the InChIKey of 1-(3-methyltriazol-4-yl)-2-pyrrolidin-1-ylethanamine?
The InChIKey is IVNSZHAVRKMVLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N5/c1-13-9(6-11-12-13)8(10)7-14-4-2-3-5-14/h6,8H,2-5,7,10H2,1H3.
What are the key properties of 1-(3-methyltriazol-4-yl)-2-pyrrolidin-1-ylethanamine?
1-(3-methyltriazol-4-yl)-2-pyrrolidin-1-ylethanamine has a molecular weight of 195.27 g/mol, XLogP of -0.09, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methyltriazol-4-yl)-2-pyrrolidin-1-ylethanamine is sourced from PubChem (CID 130730117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).