N-[[5-[3-(methoxymethyl)piperidin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine

C13H24N4O2 — CID 106959508

IUPACN-[[5-[3-(methoxymethyl)piperidin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine
SMILESCOCC1CCCN(c2nnc(CNC(C)C)o2)C1
InChIInChI=1S/C13H24N4O2/c1-10(2)14-7-12-15-16-13(19-12)17-6-4-5-11(8-17)9-18-3/h10-11,14H,4-9H2,1-3H3
InChIKeyOIJAJGZYYUGYSD-UHFFFAOYSA-N
MW268.36 g/mol
LogP1.43
Rot. Bonds6

About N-[[5-[3-(methoxymethyl)piperidin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine

N-[[5-[3-(methoxymethyl)piperidin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine (PubChem CID 106959508) has the molecular formula C13H24N4O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is N-[[5-[3-(methoxymethyl)piperidin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[5-[3-(methoxymethyl)piperidin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine
PubChem CID106959508
Molecular FormulaC13H24N4O2
Molecular Weight268.36 g/mol
Exact Mass268.19
IUPAC NameN-[[5-[3-(methoxymethyl)piperidin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine
SMILESCOCC1CCCN(c2nnc(CNC(C)C)o2)C1
InChIInChI=1S/C13H24N4O2/c1-10(2)14-7-12-15-16-13(19-12)17-6-4-5-11(8-17)9-18-3/h10-11,14H,4-9H2,1-3H3
InChIKeyOIJAJGZYYUGYSD-UHFFFAOYSA-N
XLogP1.43
TPSA63.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[5-(3-ethylpiperidin-1-yl)-1,3,4-oxadiazol-2-yl]methyl]-2-methylpropan-2-amine
CID 106969286
N-[1-[5-[3-(methoxymethyl)pyrrolidin-1-yl]-1,3,4-oxadiazol-2-yl]ethyl]propan-1-amine
CID 106962292
2-[1-[5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidin-4-yl]acetamide
CID 106960185
N-methyl-1-[5-[3-[(2-methylphenoxy)methyl]piperidin-1-yl]-1,3,4-oxadiazol-2-yl]methanamine
CID 137336258
[5-(3-ethylpiperidin-1-yl)-1,3,4-oxadiazol-2-yl]methanamine
CID 106969278
1-[5-[(2-methoxyethylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidin-3-ol
CID 106959478
N-[[3-[3-(methoxymethyl)piperidin-1-yl]-4-pyridinyl]methyl]propan-2-amine
CID 106589227
N-[[5-(cyclobutylmethyl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine
CID 103166366
1-[5-(4-ethylazepan-1-yl)-1,3,4-oxadiazol-2-yl]-N-methylmethanamine
CID 106962399
4-[5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-yl]-1,4-diazepan-2-one
CID 106961841
N-[[5-(3-ethylpyrrolidin-1-yl)-1,3,4-oxadiazol-2-yl]methyl]-2-methylpropan-1-amine
CID 106964439
N-[[5-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-2-methylpropan-1-amine
CID 106962939

Frequently Asked Questions

What is the IUPAC name of N-[[5-[3-(methoxymethyl)piperidin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine?
The IUPAC name of N-[[5-[3-(methoxymethyl)piperidin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine (CID 106959508) is N-[[5-[3-(methoxymethyl)piperidin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[5-[3-(methoxymethyl)piperidin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[5-[3-(methoxymethyl)piperidin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine is COCC1CCCN(c2nnc(CNC(C)C)o2)C1.
What is the InChIKey of N-[[5-[3-(methoxymethyl)piperidin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine?
The InChIKey is OIJAJGZYYUGYSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O2/c1-10(2)14-7-12-15-16-13(19-12)17-6-4-5-11(8-17)9-18-3/h10-11,14H,4-9H2,1-3H3.
What are the key properties of N-[[5-[3-(methoxymethyl)piperidin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine?
N-[[5-[3-(methoxymethyl)piperidin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine has a molecular weight of 268.36 g/mol, XLogP of 1.43, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[3-(methoxymethyl)piperidin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine is sourced from PubChem (CID 106959508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).