1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine

C11H18N4 — CID 62721241

IUPAC1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine
SMILESCn1nc(C2CC2)nc1C1(N)CCCC1
InChIInChI=1S/C11H18N4/c1-15-10(11(12)6-2-3-7-11)13-9(14-15)8-4-5-8/h8H,2-7,12H2,1H3
InChIKeyTVCHYPWZQNYWMD-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.42
Rot. Bonds2

About 1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine

1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine (PubChem CID 62721241) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine
PubChem CID62721241
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine
SMILESCn1nc(C2CC2)nc1C1(N)CCCC1
InChIInChI=1S/C11H18N4/c1-15-10(11(12)6-2-3-7-11)13-9(14-15)8-4-5-8/h8H,2-7,12H2,1H3
InChIKeyTVCHYPWZQNYWMD-UHFFFAOYSA-N
XLogP1.42
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine?
The IUPAC name of 1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine (CID 62721241) is 1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine.
What is the SMILES notation for 1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine?
The canonical SMILES for 1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine is Cn1nc(C2CC2)nc1C1(N)CCCC1.
What is the InChIKey of 1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine?
The InChIKey is TVCHYPWZQNYWMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-15-10(11(12)6-2-3-7-11)13-9(14-15)8-4-5-8/h8H,2-7,12H2,1H3.
What are the key properties of 1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine?
1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine has a molecular weight of 206.29 g/mol, XLogP of 1.42, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)cyclopentan-1-amine is sourced from PubChem (CID 62721241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).