1-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)piperidin-3-amine

C10H17N5 — CID 102794256

IUPAC1-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)piperidin-3-amine
SMILESNC1CCCN(c2n[nH]c(C3CC3)n2)C1
InChIInChI=1S/C10H17N5/c11-8-2-1-5-15(6-8)10-12-9(13-14-10)7-3-4-7/h7-8H,1-6,11H2,(H,12,13,14)
InChIKeyYXUKCVVUSMZVFC-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.61
Rot. Bonds2

About 1-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)piperidin-3-amine

1-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)piperidin-3-amine (PubChem CID 102794256) has the molecular formula C10H17N5 and a molecular weight of 207.28 g/mol. Its IUPAC name is 1-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)piperidin-3-amine.

Molecular Properties

Compound Name1-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)piperidin-3-amine
PubChem CID102794256
Molecular FormulaC10H17N5
Molecular Weight207.28 g/mol
Exact Mass207.15
IUPAC Name1-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)piperidin-3-amine
SMILESNC1CCCN(c2n[nH]c(C3CC3)n2)C1
InChIInChI=1S/C10H17N5/c11-8-2-1-5-15(6-8)10-12-9(13-14-10)7-3-4-7/h7-8H,1-6,11H2,(H,12,13,14)
InChIKeyYXUKCVVUSMZVFC-UHFFFAOYSA-N
XLogP0.61
TPSA70.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)piperidin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(5-amino-1H-1,2,4-triazol-3-yl)piperidin-3-amine
CID 155290360
1-[5-(oxolan-2-yl)-1H-1,2,4-triazol-3-yl]piperidin-3-amine
CID 102794159
1-[5-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-1H-1,2,4-triazol-3-yl]pyrrolidin-3-amine
CID 102793322
1-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-4-methylpiperidin-3-amine
CID 102798903
1-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]piperidin-3-amine
CID 102794324
1-[5-(thiolan-3-yl)-1H-1,2,4-triazol-3-yl]pyrrolidin-3-amine
CID 102793360
1-[5-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1H-1,2,4-triazol-3-yl]piperidin-3-amine
CID 102794393
1-[3-(3-aminopiperidin-1-yl)-1H-1,2,4-triazol-5-yl]ethanol
CID 102794422
1-(5-cyclooctyl-1H-1,2,4-triazol-3-yl)-4-methylpiperidin-3-amine
CID 102798989
1-(5-cycloheptyl-1H-1,2,4-triazol-3-yl)-4-methylpiperidin-3-amine
CID 102798873
1-[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]piperidin-3-amine
CID 102794449
2-[3-(3-aminopiperidin-1-yl)-1H-1,2,4-triazol-5-yl]-2-methylpropan-1-ol
CID 102794172

Frequently Asked Questions

What is the IUPAC name of 1-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)piperidin-3-amine?
The IUPAC name of 1-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)piperidin-3-amine (CID 102794256) is 1-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)piperidin-3-amine.
What is the SMILES notation for 1-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)piperidin-3-amine?
The canonical SMILES for 1-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)piperidin-3-amine is NC1CCCN(c2n[nH]c(C3CC3)n2)C1.
What is the InChIKey of 1-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)piperidin-3-amine?
The InChIKey is YXUKCVVUSMZVFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5/c11-8-2-1-5-15(6-8)10-12-9(13-14-10)7-3-4-7/h7-8H,1-6,11H2,(H,12,13,14).
What are the key properties of 1-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)piperidin-3-amine?
1-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)piperidin-3-amine has a molecular weight of 207.28 g/mol, XLogP of 0.61, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)piperidin-3-amine is sourced from PubChem (CID 102794256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).