1-(cyclobutylmethyl)-5-propyltriazol-4-amine

C10H18N4 — CID 79542574

IUPAC1-(cyclobutylmethyl)-5-propyltriazol-4-amine
SMILESCCCc1c(N)nnn1CC1CCC1
InChIInChI=1S/C10H18N4/c1-2-4-9-10(11)12-13-14(9)7-8-5-3-6-8/h8H,2-7,11H2,1H3
InChIKeyRCXXJNMRHVKRSQ-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.61
Rot. Bonds4

About 1-(cyclobutylmethyl)-5-propyltriazol-4-amine

1-(cyclobutylmethyl)-5-propyltriazol-4-amine (PubChem CID 79542574) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-(cyclobutylmethyl)-5-propyltriazol-4-amine.

Molecular Properties

Compound Name1-(cyclobutylmethyl)-5-propyltriazol-4-amine
PubChem CID79542574
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name1-(cyclobutylmethyl)-5-propyltriazol-4-amine
SMILESCCCc1c(N)nnn1CC1CCC1
InChIInChI=1S/C10H18N4/c1-2-4-9-10(11)12-13-14(9)7-8-5-3-6-8/h8H,2-7,11H2,1H3
InChIKeyRCXXJNMRHVKRSQ-UHFFFAOYSA-N
XLogP1.61
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclobutylmethyl)-5-propyltriazol-4-amine?
The IUPAC name of 1-(cyclobutylmethyl)-5-propyltriazol-4-amine (CID 79542574) is 1-(cyclobutylmethyl)-5-propyltriazol-4-amine.
What is the SMILES notation for 1-(cyclobutylmethyl)-5-propyltriazol-4-amine?
The canonical SMILES for 1-(cyclobutylmethyl)-5-propyltriazol-4-amine is CCCc1c(N)nnn1CC1CCC1.
What is the InChIKey of 1-(cyclobutylmethyl)-5-propyltriazol-4-amine?
The InChIKey is RCXXJNMRHVKRSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-2-4-9-10(11)12-13-14(9)7-8-5-3-6-8/h8H,2-7,11H2,1H3.
What are the key properties of 1-(cyclobutylmethyl)-5-propyltriazol-4-amine?
1-(cyclobutylmethyl)-5-propyltriazol-4-amine has a molecular weight of 194.28 g/mol, XLogP of 1.61, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclobutylmethyl)-5-propyltriazol-4-amine is sourced from PubChem (CID 79542574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).