N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-(oxan-2-yl)ethanamine

C14H23N3O2 — CID 134710802

IUPACN-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-(oxan-2-yl)ethanamine
SMILESCN(CCC1CCCCO1)Cc1nnc(C2CC2)o1
InChIInChI=1S/C14H23N3O2/c1-17(8-7-12-4-2-3-9-18-12)10-13-15-16-14(19-13)11-5-6-11/h11-12H,2-10H2,1H3
InChIKeyASSRKQHDHMVCIB-UHFFFAOYSA-N
MW265.36 g/mol
LogP2.34
Rot. Bonds6

About N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-(oxan-2-yl)ethanamine

N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-(oxan-2-yl)ethanamine (PubChem CID 134710802) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-(oxan-2-yl)ethanamine.

Molecular Properties

Compound NameN-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-(oxan-2-yl)ethanamine
PubChem CID134710802
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC NameN-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-(oxan-2-yl)ethanamine
SMILESCN(CCC1CCCCO1)Cc1nnc(C2CC2)o1
InChIInChI=1S/C14H23N3O2/c1-17(8-7-12-4-2-3-9-18-12)10-13-15-16-14(19-13)11-5-6-11/h11-12H,2-10H2,1H3
InChIKeyASSRKQHDHMVCIB-UHFFFAOYSA-N
XLogP2.34
TPSA51.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-3-[(2S)-oxolan-2-yl]propan-1-amine
CID 124842324
4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl-methylamino]butan-2-ol
CID 111488398
N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-N-ethylcyclopentanamine
CID 71937266
4-chloro-5-methyl-6-[2-[methyl-[[5-(1-pyrimidin-2-ylpiperidin-4-yl)-1,3,4-oxadiazol-2-yl]methyl]amino]ethyl]cyclohexa-1,3-dien-1-amine
CID 147043237
1-N,2-dimethyl-1-N-[2-(oxolan-2-yl)ethyl]propane-1,2-diamine
CID 120857063
N-(dimethylsulfamoyl)-N-methyl-2-(oxan-2-yl)ethanamine
CID 110671768
1,1,3-trimethyl-3-[2-(oxan-2-yl)ethyl]urea
CID 110604883
N-[(3-chloro-4-methoxyphenyl)methyl]-N-methyl-2-[(2R)-oxan-2-yl]ethanamine
CID 99931540
N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-1-(2-phenylphenyl)methanamine
CID 51107181
methyl 4-[5-[(dimethylamino)methyl]-1,3,4-oxadiazol-2-yl]cyclohexane-1-carboxylate
CID 66677787
2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)methyl-(2-hydroxyethyl)amino]ethanol
CID 111487823
2-iodo-5-[2-(oxan-2-yl)ethyl]-1,3,4-oxadiazole
CID 114771865

Frequently Asked Questions

What is the IUPAC name of N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-(oxan-2-yl)ethanamine?
The IUPAC name of N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-(oxan-2-yl)ethanamine (CID 134710802) is N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-(oxan-2-yl)ethanamine.
What is the SMILES notation for N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-(oxan-2-yl)ethanamine?
The canonical SMILES for N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-(oxan-2-yl)ethanamine is CN(CCC1CCCCO1)Cc1nnc(C2CC2)o1.
What is the InChIKey of N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-(oxan-2-yl)ethanamine?
The InChIKey is ASSRKQHDHMVCIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-17(8-7-12-4-2-3-9-18-12)10-13-15-16-14(19-13)11-5-6-11/h11-12H,2-10H2,1H3.
What are the key properties of N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-(oxan-2-yl)ethanamine?
N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-(oxan-2-yl)ethanamine has a molecular weight of 265.36 g/mol, XLogP of 2.34, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-(oxan-2-yl)ethanamine is sourced from PubChem (CID 134710802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).