4-[methyl-[1-(methylamino)piperidin-4-yl]amino]butanamide

C11H24N4O — CID 123922611

IUPAC4-[methyl-[1-(methylamino)piperidin-4-yl]amino]butanamide
SMILESCNN1CCC(N(C)CCCC(N)=O)CC1
InChIInChI=1S/C11H24N4O/c1-13-15-8-5-10(6-9-15)14(2)7-3-4-11(12)16/h10,13H,3-9H2,1-2H3,(H2,12,16)
InChIKeyORFJPOSXQDDOOD-UHFFFAOYSA-N
MW228.34 g/mol
LogP-0.22
Rot. Bonds6

About 4-[methyl-[1-(methylamino)piperidin-4-yl]amino]butanamide

4-[methyl-[1-(methylamino)piperidin-4-yl]amino]butanamide (PubChem CID 123922611) has the molecular formula C11H24N4O and a molecular weight of 228.34 g/mol. Its IUPAC name is 4-[methyl-[1-(methylamino)piperidin-4-yl]amino]butanamide.

Molecular Properties

Compound Name4-[methyl-[1-(methylamino)piperidin-4-yl]amino]butanamide
PubChem CID123922611
Molecular FormulaC11H24N4O
Molecular Weight228.34 g/mol
Exact Mass228.20
IUPAC Name4-[methyl-[1-(methylamino)piperidin-4-yl]amino]butanamide
SMILESCNN1CCC(N(C)CCCC(N)=O)CC1
InChIInChI=1S/C11H24N4O/c1-13-15-8-5-10(6-9-15)14(2)7-3-4-11(12)16/h10,13H,3-9H2,1-2H3,(H2,12,16)
InChIKeyORFJPOSXQDDOOD-UHFFFAOYSA-N
XLogP-0.22
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[methyl-[1-(methylamino)piperidin-4-yl]amino]butanamide?
The IUPAC name of 4-[methyl-[1-(methylamino)piperidin-4-yl]amino]butanamide (CID 123922611) is 4-[methyl-[1-(methylamino)piperidin-4-yl]amino]butanamide.
What is the SMILES notation for 4-[methyl-[1-(methylamino)piperidin-4-yl]amino]butanamide?
The canonical SMILES for 4-[methyl-[1-(methylamino)piperidin-4-yl]amino]butanamide is CNN1CCC(N(C)CCCC(N)=O)CC1.
What is the InChIKey of 4-[methyl-[1-(methylamino)piperidin-4-yl]amino]butanamide?
The InChIKey is ORFJPOSXQDDOOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O/c1-13-15-8-5-10(6-9-15)14(2)7-3-4-11(12)16/h10,13H,3-9H2,1-2H3,(H2,12,16).
What are the key properties of 4-[methyl-[1-(methylamino)piperidin-4-yl]amino]butanamide?
4-[methyl-[1-(methylamino)piperidin-4-yl]amino]butanamide has a molecular weight of 228.34 g/mol, XLogP of -0.22, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[methyl-[1-(methylamino)piperidin-4-yl]amino]butanamide is sourced from PubChem (CID 123922611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).