3-(5-bromo-3-methyltriazol-4-yl)-N,3-dimethylcyclopentan-1-amine

C10H17BrN4 — CID 106463546

IUPAC3-(5-bromo-3-methyltriazol-4-yl)-N,3-dimethylcyclopentan-1-amine
SMILESCNC1CCC(C)(c2c(Br)nnn2C)C1
InChIInChI=1S/C10H17BrN4/c1-10(5-4-7(6-10)12-2)8-9(11)13-14-15(8)3/h7,12H,4-6H2,1-3H3
InChIKeyDHQNYOPAKYFQSK-UHFFFAOYSA-N
MW273.18 g/mol
LogP1.61
Rot. Bonds2

About 3-(5-bromo-3-methyltriazol-4-yl)-N,3-dimethylcyclopentan-1-amine

3-(5-bromo-3-methyltriazol-4-yl)-N,3-dimethylcyclopentan-1-amine (PubChem CID 106463546) has the molecular formula C10H17BrN4 and a molecular weight of 273.18 g/mol. Its IUPAC name is 3-(5-bromo-3-methyltriazol-4-yl)-N,3-dimethylcyclopentan-1-amine.

Molecular Properties

Compound Name3-(5-bromo-3-methyltriazol-4-yl)-N,3-dimethylcyclopentan-1-amine
PubChem CID106463546
Molecular FormulaC10H17BrN4
Molecular Weight273.18 g/mol
Exact Mass272.06
IUPAC Name3-(5-bromo-3-methyltriazol-4-yl)-N,3-dimethylcyclopentan-1-amine
SMILESCNC1CCC(C)(c2c(Br)nnn2C)C1
InChIInChI=1S/C10H17BrN4/c1-10(5-4-7(6-10)12-2)8-9(11)13-14-15(8)3/h7,12H,4-6H2,1-3H3
InChIKeyDHQNYOPAKYFQSK-UHFFFAOYSA-N
XLogP1.61
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.18
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(5-bromo-3-methyltriazol-4-yl)-N,3-dimethylcyclopentan-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

N,3-dimethyl-3-(2-methyltriazol-4-yl)cyclopentan-1-amine
CID 130603161
3-(4-bromothiophen-3-yl)-N,3-dimethylcyclopentan-1-amine
CID 116539257
1-(5-bromo-3-methyltriazol-4-yl)piperidin-4-amine
CID 106463347
1-(5-bromo-3-methyltriazol-4-yl)-1-(3,3-difluorocyclohexyl)-N-methylmethanamine
CID 114215947
3-(5-bromo-3-methyltriazol-4-yl)azetidin-3-ol
CID 106461280
3-(3,4-dichlorophenyl)-N,3-dimethylcyclopentan-1-amine
CID 116539237
N-[[2-(5-bromo-3-methyltriazol-4-yl)-4,4-dimethylcyclohexyl]methyl]-2-methylpropan-2-amine
CID 106463997
3-(2-ethylpyrazol-3-yl)-N,3-dimethylcyclopentan-1-amine
CID 116539246
1-(5-bromo-3-methyltriazol-4-yl)-2-phenylcyclohexan-1-ol
CID 106461059
3-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-N,3-dimethylcyclopentan-1-amine
CID 116539264
3-[2-(2-methoxyethyl)pyrazol-3-yl]-N,3-dimethylcyclopentan-1-amine
CID 114277847
3-(5-bromo-3-methyltriazol-4-yl)piperidin-3-ol
CID 106461103

Frequently Asked Questions

What is the IUPAC name of 3-(5-bromo-3-methyltriazol-4-yl)-N,3-dimethylcyclopentan-1-amine?
The IUPAC name of 3-(5-bromo-3-methyltriazol-4-yl)-N,3-dimethylcyclopentan-1-amine (CID 106463546) is 3-(5-bromo-3-methyltriazol-4-yl)-N,3-dimethylcyclopentan-1-amine.
What is the SMILES notation for 3-(5-bromo-3-methyltriazol-4-yl)-N,3-dimethylcyclopentan-1-amine?
The canonical SMILES for 3-(5-bromo-3-methyltriazol-4-yl)-N,3-dimethylcyclopentan-1-amine is CNC1CCC(C)(c2c(Br)nnn2C)C1.
What is the InChIKey of 3-(5-bromo-3-methyltriazol-4-yl)-N,3-dimethylcyclopentan-1-amine?
The InChIKey is DHQNYOPAKYFQSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17BrN4/c1-10(5-4-7(6-10)12-2)8-9(11)13-14-15(8)3/h7,12H,4-6H2,1-3H3.
What are the key properties of 3-(5-bromo-3-methyltriazol-4-yl)-N,3-dimethylcyclopentan-1-amine?
3-(5-bromo-3-methyltriazol-4-yl)-N,3-dimethylcyclopentan-1-amine has a molecular weight of 273.18 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-bromo-3-methyltriazol-4-yl)-N,3-dimethylcyclopentan-1-amine is sourced from PubChem (CID 106463546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).