3-cyclopentyl-N-ethyl-1-(3-propyltriazol-4-yl)propan-1-amine

C15H28N4 — CID 105038705

IUPAC3-cyclopentyl-N-ethyl-1-(3-propyltriazol-4-yl)propan-1-amine
SMILESCCCn1nncc1C(CCC1CCCC1)NCC
InChIInChI=1S/C15H28N4/c1-3-11-19-15(12-17-18-19)14(16-4-2)10-9-13-7-5-6-8-13/h12-14,16H,3-11H2,1-2H3
InChIKeyKAKSCRQZCOZIDO-UHFFFAOYSA-N
MW264.42 g/mol
LogP3.31
Rot. Bonds8

About 3-cyclopentyl-N-ethyl-1-(3-propyltriazol-4-yl)propan-1-amine

3-cyclopentyl-N-ethyl-1-(3-propyltriazol-4-yl)propan-1-amine (PubChem CID 105038705) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is 3-cyclopentyl-N-ethyl-1-(3-propyltriazol-4-yl)propan-1-amine.

Molecular Properties

Compound Name3-cyclopentyl-N-ethyl-1-(3-propyltriazol-4-yl)propan-1-amine
PubChem CID105038705
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC Name3-cyclopentyl-N-ethyl-1-(3-propyltriazol-4-yl)propan-1-amine
SMILESCCCn1nncc1C(CCC1CCCC1)NCC
InChIInChI=1S/C15H28N4/c1-3-11-19-15(12-17-18-19)14(16-4-2)10-9-13-7-5-6-8-13/h12-14,16H,3-11H2,1-2H3
InChIKeyKAKSCRQZCOZIDO-UHFFFAOYSA-N
XLogP3.31
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-1-(3-propyltriazol-4-yl)pentan-1-amine
CID 114688493
2-cyclopropyl-N-ethyl-1-(3-propyltriazol-4-yl)propan-1-amine
CID 105038639
2-cyclopentyl-1-(3-propyltriazol-4-yl)ethanol
CID 115834151
N-ethyl-3,5,5-trimethyl-1-(3-propyltriazol-4-yl)hexan-1-amine
CID 105038801
[(4-propylcyclohexyl)-(3-propyltriazol-4-yl)methyl]hydrazine
CID 105232238
N-ethyl-3-(2-methylphenyl)-1-(3-propyltriazol-4-yl)propan-1-amine
CID 105182279
[cyclooctyl-(3-propyltriazol-4-yl)methyl]hydrazine
CID 105255083
N-[cyclohexyl-(3-propyltriazol-4-yl)methyl]propan-1-amine
CID 114687200
N-[(1,4-dimethylpiperazin-2-yl)-(3-propyltriazol-4-yl)methyl]ethanamine
CID 114688546
N-[(3-propyltriazol-4-yl)-(thiolan-2-yl)methyl]ethanamine
CID 114688770
N-[2-(oxan-2-yl)-1-(3-propyltriazol-4-yl)ethyl]propan-1-amine
CID 114689062
cyclopentyl-(3-propyltriazol-4-yl)methanol
CID 114684940

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-ethyl-1-(3-propyltriazol-4-yl)propan-1-amine?
The IUPAC name of 3-cyclopentyl-N-ethyl-1-(3-propyltriazol-4-yl)propan-1-amine (CID 105038705) is 3-cyclopentyl-N-ethyl-1-(3-propyltriazol-4-yl)propan-1-amine.
What is the SMILES notation for 3-cyclopentyl-N-ethyl-1-(3-propyltriazol-4-yl)propan-1-amine?
The canonical SMILES for 3-cyclopentyl-N-ethyl-1-(3-propyltriazol-4-yl)propan-1-amine is CCCn1nncc1C(CCC1CCCC1)NCC.
What is the InChIKey of 3-cyclopentyl-N-ethyl-1-(3-propyltriazol-4-yl)propan-1-amine?
The InChIKey is KAKSCRQZCOZIDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-3-11-19-15(12-17-18-19)14(16-4-2)10-9-13-7-5-6-8-13/h12-14,16H,3-11H2,1-2H3.
What are the key properties of 3-cyclopentyl-N-ethyl-1-(3-propyltriazol-4-yl)propan-1-amine?
3-cyclopentyl-N-ethyl-1-(3-propyltriazol-4-yl)propan-1-amine has a molecular weight of 264.42 g/mol, XLogP of 3.31, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-ethyl-1-(3-propyltriazol-4-yl)propan-1-amine is sourced from PubChem (CID 105038705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).