5-(4-aminopentyl)-1,2,4-oxadiazole-3-carboxamide

C8H14N4O2 — CID 102790082

IUPAC5-(4-aminopentyl)-1,2,4-oxadiazole-3-carboxamide
SMILESCC(N)CCCc1nc(C(N)=O)no1
InChIInChI=1S/C8H14N4O2/c1-5(9)3-2-4-6-11-8(7(10)13)12-14-6/h5H,2-4,9H2,1H3,(H2,10,13)
InChIKeyNVKPNUVPVDJYAL-UHFFFAOYSA-N
MW198.23 g/mol
LogP-0.16
Rot. Bonds5

About 5-(4-aminopentyl)-1,2,4-oxadiazole-3-carboxamide

5-(4-aminopentyl)-1,2,4-oxadiazole-3-carboxamide (PubChem CID 102790082) has the molecular formula C8H14N4O2 and a molecular weight of 198.23 g/mol. Its IUPAC name is 5-(4-aminopentyl)-1,2,4-oxadiazole-3-carboxamide.

Molecular Properties

Compound Name5-(4-aminopentyl)-1,2,4-oxadiazole-3-carboxamide
PubChem CID102790082
Molecular FormulaC8H14N4O2
Molecular Weight198.23 g/mol
Exact Mass198.11
IUPAC Name5-(4-aminopentyl)-1,2,4-oxadiazole-3-carboxamide
SMILESCC(N)CCCc1nc(C(N)=O)no1
InChIInChI=1S/C8H14N4O2/c1-5(9)3-2-4-6-11-8(7(10)13)12-14-6/h5H,2-4,9H2,1H3,(H2,10,13)
InChIKeyNVKPNUVPVDJYAL-UHFFFAOYSA-N
XLogP-0.16
TPSA108.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-(4-aminopentyl)-1,2,4-oxadiazole-3-carboxamide 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

5-(4-aminopentyl)-1,2,4-oxadiazole-3-carboxylic acid
CID 112631792
5-[2-(tert-butylamino)ethyl]-1,2,4-oxadiazole-3-carboxamide
CID 102790052
5-(methylaminomethyl)-1,2,4-oxadiazole-3-carboxamide
CID 102790320
5-[2-(aminomethyl)butyl]-1,2,4-oxadiazole-3-carboxamide
CID 102790253
5-[3-(3,4-difluorophenyl)-1,2,4-oxadiazol-5-yl]pentan-2-amine
CID 82846767
5-[(hexan-3-ylamino)methyl]-1,2,4-oxadiazole-3-carboxamide
CID 138623161
5-[(1R)-1-amino-2-methylpropyl]-1,2,4-oxadiazole-3-carboxamide
CID 102790267
5-[3-(4,4-dimethylcyclohexyl)-1,2,4-oxadiazol-5-yl]pentan-2-amine
CID 82845855
5-[3-(3-chloro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]pentan-2-amine
CID 103442844
5-[3-(1-methylimidazol-2-yl)-1,2,4-oxadiazol-5-yl]pentan-2-amine
CID 82845644
5-[3-(1-methoxycyclobutyl)-1,2,4-oxadiazol-5-yl]pentan-2-amine
CID 116701311
5-[3-(2-aminoethyl)-4-methylpentyl]-1,2,4-oxadiazole-3-carboxylic acid
CID 112631943

Frequently Asked Questions

What is the IUPAC name of 5-(4-aminopentyl)-1,2,4-oxadiazole-3-carboxamide?
The IUPAC name of 5-(4-aminopentyl)-1,2,4-oxadiazole-3-carboxamide (CID 102790082) is 5-(4-aminopentyl)-1,2,4-oxadiazole-3-carboxamide.
What is the SMILES notation for 5-(4-aminopentyl)-1,2,4-oxadiazole-3-carboxamide?
The canonical SMILES for 5-(4-aminopentyl)-1,2,4-oxadiazole-3-carboxamide is CC(N)CCCc1nc(C(N)=O)no1.
What is the InChIKey of 5-(4-aminopentyl)-1,2,4-oxadiazole-3-carboxamide?
The InChIKey is NVKPNUVPVDJYAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O2/c1-5(9)3-2-4-6-11-8(7(10)13)12-14-6/h5H,2-4,9H2,1H3,(H2,10,13).
What are the key properties of 5-(4-aminopentyl)-1,2,4-oxadiazole-3-carboxamide?
5-(4-aminopentyl)-1,2,4-oxadiazole-3-carboxamide has a molecular weight of 198.23 g/mol, XLogP of -0.16, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-aminopentyl)-1,2,4-oxadiazole-3-carboxamide is sourced from PubChem (CID 102790082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).