1-(5-bromo-3-methyltriazol-4-yl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine

C14H24BrN5 — CID 106462661

IUPAC1-(5-bromo-3-methyltriazol-4-yl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine
SMILESCNC(c1c(Br)nnn1C)C1(N2CCCC2)CCCC1
InChIInChI=1S/C14H24BrN5/c1-16-12(11-13(15)17-18-19(11)2)14(7-3-4-8-14)20-9-5-6-10-20/h12,16H,3-10H2,1-2H3
InChIKeyQTYAEQYASLJIEV-UHFFFAOYSA-N
MW342.29 g/mol
LogP2.25
Rot. Bonds4

About 1-(5-bromo-3-methyltriazol-4-yl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine

1-(5-bromo-3-methyltriazol-4-yl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine (PubChem CID 106462661) has the molecular formula C14H24BrN5 and a molecular weight of 342.29 g/mol. Its IUPAC name is 1-(5-bromo-3-methyltriazol-4-yl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine.

Molecular Properties

Compound Name1-(5-bromo-3-methyltriazol-4-yl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine
PubChem CID106462661
Molecular FormulaC14H24BrN5
Molecular Weight342.29 g/mol
Exact Mass341.12
IUPAC Name1-(5-bromo-3-methyltriazol-4-yl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine
SMILESCNC(c1c(Br)nnn1C)C1(N2CCCC2)CCCC1
InChIInChI=1S/C14H24BrN5/c1-16-12(11-13(15)17-18-19(11)2)14(7-3-4-8-14)20-9-5-6-10-20/h12,16H,3-10H2,1-2H3
InChIKeyQTYAEQYASLJIEV-UHFFFAOYSA-N
XLogP2.25
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.29
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(5-bromo-3-methyltriazol-4-yl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine 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-methyl-1-(3-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine
CID 114688398
1-(5-bromo-3-methyltriazol-4-yl)-1-(4-ethoxyoxan-4-yl)-N-methylmethanamine
CID 106463020
N-[(5-bromo-3-methyltriazol-4-yl)-(1-methylcyclohexyl)methyl]ethanamine
CID 106830779
1-[(5-bromo-3-methyltriazol-4-yl)-(ethylamino)methyl]-N,N-dimethylcyclopentan-1-amine
CID 106462655
[(5-bromo-3-methyltriazol-4-yl)-(1-ethoxycycloheptyl)methyl]hydrazine
CID 106466257
1-(5-bromo-3-methyltriazol-4-yl)-1-(3,3-difluorocyclohexyl)-N-methylmethanamine
CID 114215947
N-methyl-1-(1-methylpyrazol-3-yl)-1-(1-piperidin-1-ylcyclopentyl)methanamine
CID 103131090
N-[(5-bromo-3-methyltriazol-4-yl)-(1-methoxycyclopentyl)methyl]propan-1-amine
CID 106462943
1-(5-bromo-3-methyltriazol-4-yl)-N,2-dimethylpropan-1-amine
CID 106462131
N-methyl-2-(1-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine
CID 107049969
1-(furan-3-yl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine
CID 79060580
N-methyl-1-(2-propylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine
CID 79059475

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-3-methyltriazol-4-yl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine?
The IUPAC name of 1-(5-bromo-3-methyltriazol-4-yl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine (CID 106462661) is 1-(5-bromo-3-methyltriazol-4-yl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine.
What is the SMILES notation for 1-(5-bromo-3-methyltriazol-4-yl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine?
The canonical SMILES for 1-(5-bromo-3-methyltriazol-4-yl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine is CNC(c1c(Br)nnn1C)C1(N2CCCC2)CCCC1.
What is the InChIKey of 1-(5-bromo-3-methyltriazol-4-yl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine?
The InChIKey is QTYAEQYASLJIEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24BrN5/c1-16-12(11-13(15)17-18-19(11)2)14(7-3-4-8-14)20-9-5-6-10-20/h12,16H,3-10H2,1-2H3.
What are the key properties of 1-(5-bromo-3-methyltriazol-4-yl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine?
1-(5-bromo-3-methyltriazol-4-yl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine has a molecular weight of 342.29 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-3-methyltriazol-4-yl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine is sourced from PubChem (CID 106462661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).