N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-3-(5-methyltetrazol-1-yl)propanamide

C11H17N7O2 — CID 91792687

IUPACN-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-3-(5-methyltetrazol-1-yl)propanamide
SMILESCCC(NC(=O)CCn1nnnc1C)c1nc(C)no1
InChIInChI=1S/C11H17N7O2/c1-4-9(11-12-7(2)15-20-11)13-10(19)5-6-18-8(3)14-16-17-18/h9H,4-6H2,1-3H3,(H,13,19)
InChIKeyHMULKRWEBZSIRE-UHFFFAOYSA-N
MW279.30 g/mol
LogP0.33
Rot. Bonds6

About N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-3-(5-methyltetrazol-1-yl)propanamide

N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-3-(5-methyltetrazol-1-yl)propanamide (PubChem CID 91792687) has the molecular formula C11H17N7O2 and a molecular weight of 279.30 g/mol. Its IUPAC name is N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-3-(5-methyltetrazol-1-yl)propanamide.

Molecular Properties

Compound NameN-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-3-(5-methyltetrazol-1-yl)propanamide
PubChem CID91792687
Molecular FormulaC11H17N7O2
Molecular Weight279.30 g/mol
Exact Mass279.14
IUPAC NameN-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-3-(5-methyltetrazol-1-yl)propanamide
SMILESCCC(NC(=O)CCn1nnnc1C)c1nc(C)no1
InChIInChI=1S/C11H17N7O2/c1-4-9(11-12-7(2)15-20-11)13-10(19)5-6-18-8(3)14-16-17-18/h9H,4-6H2,1-3H3,(H,13,19)
InChIKeyHMULKRWEBZSIRE-UHFFFAOYSA-N
XLogP0.33
TPSA111.62 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

N-[1-(1-methylimidazol-2-yl)butyl]-3-(5-methyltetrazol-1-yl)propanamide
CID 135101819
3-(5-methyltetrazol-1-yl)-N-[1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethyl]propanamide
CID 118788261
N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pentanamide
CID 60606531
N-[1-(2-ethyl-1,2,4-triazol-3-yl)ethyl]-3-(5-methyltetrazol-1-yl)propanamide
CID 91784996
4-chloro-1,5-dimethyl-N-[(1R)-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]pyrazole-3-carboxamide
CID 125165236
4-ethyl-2-methyl-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1,3-thiazole-5-carboxamide
CID 118774250
methyl 3-(5-methyltetrazol-1-yl)propanoate
CID 59922425
3-(5-methyltetrazol-1-yl)-N-(2-methyl-1-thiophen-2-ylpropyl)propanamide
CID 46960745
3-(5-methyltetrazol-1-yl)propanoate
CID 7219833
N-[furan-2-yl(phenyl)methyl]-3-(5-methyltetrazol-1-yl)propanamide
CID 131898891
1-(cyclopentanecarbonyl)-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidine-4-carboxamide
CID 72884711
1-(cyclobutanecarbonyl)-N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidine-4-carboxamide
CID 97200457

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-3-(5-methyltetrazol-1-yl)propanamide?
The IUPAC name of N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-3-(5-methyltetrazol-1-yl)propanamide (CID 91792687) is N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-3-(5-methyltetrazol-1-yl)propanamide.
What is the SMILES notation for N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-3-(5-methyltetrazol-1-yl)propanamide?
The canonical SMILES for N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-3-(5-methyltetrazol-1-yl)propanamide is CCC(NC(=O)CCn1nnnc1C)c1nc(C)no1.
What is the InChIKey of N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-3-(5-methyltetrazol-1-yl)propanamide?
The InChIKey is HMULKRWEBZSIRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N7O2/c1-4-9(11-12-7(2)15-20-11)13-10(19)5-6-18-8(3)14-16-17-18/h9H,4-6H2,1-3H3,(H,13,19).
What are the key properties of N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-3-(5-methyltetrazol-1-yl)propanamide?
N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-3-(5-methyltetrazol-1-yl)propanamide has a molecular weight of 279.30 g/mol, XLogP of 0.33, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-3-(5-methyltetrazol-1-yl)propanamide is sourced from PubChem (CID 91792687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).