(2R)-2-(4-cyclopropyl-1,2,4-triazol-3-yl)piperidine

C10H16N4 — CID 104915223

IUPAC(2R)-2-(4-cyclopropyl-1,2,4-triazol-3-yl)piperidine
SMILESc1nnc([C@H]2CCCCN2)n1C1CC1
InChIInChI=1S/C10H16N4/c1-2-6-11-9(3-1)10-13-12-7-14(10)8-4-5-8/h7-9,11H,1-6H2/t9-/m1/s1
InChIKeyVOANHVLCNYRUKV-SECBINFHSA-N
MW192.27 g/mol
LogP1.43
Rot. Bonds2

About (2R)-2-(4-cyclopropyl-1,2,4-triazol-3-yl)piperidine

(2R)-2-(4-cyclopropyl-1,2,4-triazol-3-yl)piperidine (PubChem CID 104915223) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is (2R)-2-(4-cyclopropyl-1,2,4-triazol-3-yl)piperidine.

Molecular Properties

Compound Name(2R)-2-(4-cyclopropyl-1,2,4-triazol-3-yl)piperidine
PubChem CID104915223
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name(2R)-2-(4-cyclopropyl-1,2,4-triazol-3-yl)piperidine
SMILESc1nnc([C@H]2CCCCN2)n1C1CC1
InChIInChI=1S/C10H16N4/c1-2-6-11-9(3-1)10-13-12-7-14(10)8-4-5-8/h7-9,11H,1-6H2/t9-/m1/s1
InChIKeyVOANHVLCNYRUKV-SECBINFHSA-N
XLogP1.43
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-cyclopropyl-1,2,4-triazol-3-yl)piperidine?
The IUPAC name of (2R)-2-(4-cyclopropyl-1,2,4-triazol-3-yl)piperidine (CID 104915223) is (2R)-2-(4-cyclopropyl-1,2,4-triazol-3-yl)piperidine.
What is the SMILES notation for (2R)-2-(4-cyclopropyl-1,2,4-triazol-3-yl)piperidine?
The canonical SMILES for (2R)-2-(4-cyclopropyl-1,2,4-triazol-3-yl)piperidine is c1nnc([C@H]2CCCCN2)n1C1CC1.
What is the InChIKey of (2R)-2-(4-cyclopropyl-1,2,4-triazol-3-yl)piperidine?
The InChIKey is VOANHVLCNYRUKV-SECBINFHSA-N. The full InChI is InChI=1S/C10H16N4/c1-2-6-11-9(3-1)10-13-12-7-14(10)8-4-5-8/h7-9,11H,1-6H2/t9-/m1/s1.
What are the key properties of (2R)-2-(4-cyclopropyl-1,2,4-triazol-3-yl)piperidine?
(2R)-2-(4-cyclopropyl-1,2,4-triazol-3-yl)piperidine has a molecular weight of 192.27 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-cyclopropyl-1,2,4-triazol-3-yl)piperidine is sourced from PubChem (CID 104915223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).