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

C14H26N4O — CID 63847441

IUPAC2-methyl-N-[[1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]methyl]propan-2-amine
SMILESCc1nc(CN2CCCC(CNC(C)(C)C)C2)no1
InChIInChI=1S/C14H26N4O/c1-11-16-13(17-19-11)10-18-7-5-6-12(9-18)8-15-14(2,3)4/h12,15H,5-10H2,1-4H3
InChIKeyYFZRHPNIAACNDQ-UHFFFAOYSA-N
MW266.39 g/mol
LogP1.98
Rot. Bonds4

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

2-methyl-N-[[1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]methyl]propan-2-amine (PubChem CID 63847441) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is 2-methyl-N-[[1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]methyl]propan-2-amine
PubChem CID63847441
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC Name2-methyl-N-[[1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]methyl]propan-2-amine
SMILESCc1nc(CN2CCCC(CNC(C)(C)C)C2)no1
InChIInChI=1S/C14H26N4O/c1-11-16-13(17-19-11)10-18-7-5-6-12(9-18)8-15-14(2,3)4/h12,15H,5-10H2,1-4H3
InChIKeyYFZRHPNIAACNDQ-UHFFFAOYSA-N
XLogP1.98
TPSA54.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]methyl]propan-2-amine (CID 63847441) is 2-methyl-N-[[1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]methyl]propan-2-amine is Cc1nc(CN2CCCC(CNC(C)(C)C)C2)no1.
What is the InChIKey of 2-methyl-N-[[1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]methyl]propan-2-amine?
The InChIKey is YFZRHPNIAACNDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-11-16-13(17-19-11)10-18-7-5-6-12(9-18)8-15-14(2,3)4/h12,15H,5-10H2,1-4H3.
What are the key properties of 2-methyl-N-[[1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]methyl]propan-2-amine?
2-methyl-N-[[1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]methyl]propan-2-amine has a molecular weight of 266.39 g/mol, XLogP of 1.98, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]methyl]propan-2-amine is sourced from PubChem (CID 63847441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).