N-[1-(4-methylpiperidine-4-carbonyl)piperidin-4-yl]propanamide

C15H27N3O2 — CID 63122079

IUPACN-[1-(4-methylpiperidine-4-carbonyl)piperidin-4-yl]propanamide
SMILESCCC(=O)NC1CCN(C(=O)C2(C)CCNCC2)CC1
InChIInChI=1S/C15H27N3O2/c1-3-13(19)17-12-4-10-18(11-5-12)14(20)15(2)6-8-16-9-7-15/h12,16H,3-11H2,1-2H3,(H,17,19)
InChIKeyHCEYJFTWYNDDJR-UHFFFAOYSA-N
MW281.40 g/mol
LogP0.89
Rot. Bonds3

About N-[1-(4-methylpiperidine-4-carbonyl)piperidin-4-yl]propanamide

N-[1-(4-methylpiperidine-4-carbonyl)piperidin-4-yl]propanamide (PubChem CID 63122079) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is N-[1-(4-methylpiperidine-4-carbonyl)piperidin-4-yl]propanamide.

Molecular Properties

Compound NameN-[1-(4-methylpiperidine-4-carbonyl)piperidin-4-yl]propanamide
PubChem CID63122079
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC NameN-[1-(4-methylpiperidine-4-carbonyl)piperidin-4-yl]propanamide
SMILESCCC(=O)NC1CCN(C(=O)C2(C)CCNCC2)CC1
InChIInChI=1S/C15H27N3O2/c1-3-13(19)17-12-4-10-18(11-5-12)14(20)15(2)6-8-16-9-7-15/h12,16H,3-11H2,1-2H3,(H,17,19)
InChIKeyHCEYJFTWYNDDJR-UHFFFAOYSA-N
XLogP0.89
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methylpiperidine-4-carbonyl)piperidin-4-yl]propanamide?
The IUPAC name of N-[1-(4-methylpiperidine-4-carbonyl)piperidin-4-yl]propanamide (CID 63122079) is N-[1-(4-methylpiperidine-4-carbonyl)piperidin-4-yl]propanamide.
What is the SMILES notation for N-[1-(4-methylpiperidine-4-carbonyl)piperidin-4-yl]propanamide?
The canonical SMILES for N-[1-(4-methylpiperidine-4-carbonyl)piperidin-4-yl]propanamide is CCC(=O)NC1CCN(C(=O)C2(C)CCNCC2)CC1.
What is the InChIKey of N-[1-(4-methylpiperidine-4-carbonyl)piperidin-4-yl]propanamide?
The InChIKey is HCEYJFTWYNDDJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-3-13(19)17-12-4-10-18(11-5-12)14(20)15(2)6-8-16-9-7-15/h12,16H,3-11H2,1-2H3,(H,17,19).
What are the key properties of N-[1-(4-methylpiperidine-4-carbonyl)piperidin-4-yl]propanamide?
N-[1-(4-methylpiperidine-4-carbonyl)piperidin-4-yl]propanamide has a molecular weight of 281.40 g/mol, XLogP of 0.89, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methylpiperidine-4-carbonyl)piperidin-4-yl]propanamide is sourced from PubChem (CID 63122079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).