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

C11H20N4 — CID 62720541

IUPAC1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)pentan-1-amine
SMILESCCCCC(N)c1nc(C2CC2)nn1C
InChIInChI=1S/C11H20N4/c1-3-4-5-9(12)11-13-10(8-6-7-8)14-15(11)2/h8-9H,3-7,12H2,1-2H3
InChIKeyUOMJGVAKKAMZJV-UHFFFAOYSA-N
MW208.31 g/mol
LogP1.88
Rot. Bonds5

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

1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)pentan-1-amine (PubChem CID 62720541) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)pentan-1-amine.

Molecular Properties

Compound Name1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)pentan-1-amine
PubChem CID62720541
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)pentan-1-amine
SMILESCCCCC(N)c1nc(C2CC2)nn1C
InChIInChI=1S/C11H20N4/c1-3-4-5-9(12)11-13-10(8-6-7-8)14-15(11)2/h8-9H,3-7,12H2,1-2H3
InChIKeyUOMJGVAKKAMZJV-UHFFFAOYSA-N
XLogP1.88
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methyl-5-propyl-1,2,4-triazol-3-yl)pentan-1-amine
CID 62722130
1-(5-cyclopentyl-2-methyl-1,2,4-triazol-3-yl)-3-methylbutan-1-amine
CID 62722708
2-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)propan-1-amine
CID 62720886
(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)methanamine
CID 62720360
1-(2-methyl-5-propyl-1,2,4-triazol-3-yl)butan-1-amine
CID 62722127
1-(5-cyclohexyl-2-methyl-1,2,4-triazol-3-yl)-N-methylpropan-1-amine
CID 62722907
1-[3-(4-ethylcyclohexyl)-1,2,4-oxadiazol-5-yl]pentan-1-amine
CID 65395345
(1S)-1-[3-(4-ethylcyclohexyl)-1,2,4-oxadiazol-5-yl]pentan-1-amine
CID 107144988
6-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)hexan-1-amine
CID 62721244
(1S)-1-(5-cyclopentyl-1H-1,2,4-triazol-3-yl)pentan-1-amine
CID 107146724
(1S)-1-(5-cyclohexyl-1H-1,2,4-triazol-3-yl)pentan-1-amine
CID 107146725
N-[(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)methyl]propan-1-amine
CID 62720716

Frequently Asked Questions

What is the IUPAC name of 1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)pentan-1-amine?
The IUPAC name of 1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)pentan-1-amine (CID 62720541) is 1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)pentan-1-amine.
What is the SMILES notation for 1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)pentan-1-amine?
The canonical SMILES for 1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)pentan-1-amine is CCCCC(N)c1nc(C2CC2)nn1C.
What is the InChIKey of 1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)pentan-1-amine?
The InChIKey is UOMJGVAKKAMZJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-3-4-5-9(12)11-13-10(8-6-7-8)14-15(11)2/h8-9H,3-7,12H2,1-2H3.
What are the key properties of 1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)pentan-1-amine?
1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)pentan-1-amine has a molecular weight of 208.31 g/mol, XLogP of 1.88, 5 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)pentan-1-amine is sourced from PubChem (CID 62720541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).