[4-(methylamino)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone

C13H25N3O — CID 79152319

IUPAC[4-(methylamino)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone
SMILESCNC1CCN(C(=O)N2CCC(C)CC2)CC1
InChIInChI=1S/C13H25N3O/c1-11-3-7-15(8-4-11)13(17)16-9-5-12(14-2)6-10-16/h11-12,14H,3-10H2,1-2H3
InChIKeyYEIZYRCQBNHFQB-UHFFFAOYSA-N
MW239.36 g/mol
LogP1.52
Rot. Bonds1

About [4-(methylamino)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone

[4-(methylamino)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone (PubChem CID 79152319) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is [4-(methylamino)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name[4-(methylamino)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone
PubChem CID79152319
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name[4-(methylamino)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone
SMILESCNC1CCN(C(=O)N2CCC(C)CC2)CC1
InChIInChI=1S/C13H25N3O/c1-11-3-7-15(8-4-11)13(17)16-9-5-12(14-2)6-10-16/h11-12,14H,3-10H2,1-2H3
InChIKeyYEIZYRCQBNHFQB-UHFFFAOYSA-N
XLogP1.52
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(methylamino)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone?
The IUPAC name of [4-(methylamino)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone (CID 79152319) is [4-(methylamino)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone.
What is the SMILES notation for [4-(methylamino)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone?
The canonical SMILES for [4-(methylamino)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone is CNC1CCN(C(=O)N2CCC(C)CC2)CC1.
What is the InChIKey of [4-(methylamino)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone?
The InChIKey is YEIZYRCQBNHFQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-11-3-7-15(8-4-11)13(17)16-9-5-12(14-2)6-10-16/h11-12,14H,3-10H2,1-2H3.
What are the key properties of [4-(methylamino)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone?
[4-(methylamino)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone has a molecular weight of 239.36 g/mol, XLogP of 1.52, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(methylamino)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 79152319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).