2-methyl-N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]propanamide

C15H29N3O — CID 45169762

IUPAC2-methyl-N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]propanamide
SMILESCC(C)C(=O)NC1CCCN(C2CCN(C)CC2)C1
InChIInChI=1S/C15H29N3O/c1-12(2)15(19)16-13-5-4-8-18(11-13)14-6-9-17(3)10-7-14/h12-14H,4-11H2,1-3H3,(H,16,19)
InChIKeyJHCDNRYHGMNMLE-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.32
Rot. Bonds3

About 2-methyl-N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]propanamide

2-methyl-N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]propanamide (PubChem CID 45169762) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-methyl-N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]propanamide
PubChem CID45169762
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name2-methyl-N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]propanamide
SMILESCC(C)C(=O)NC1CCCN(C2CCN(C)CC2)C1
InChIInChI=1S/C15H29N3O/c1-12(2)15(19)16-13-5-4-8-18(11-13)14-6-9-17(3)10-7-14/h12-14H,4-11H2,1-3H3,(H,16,19)
InChIKeyJHCDNRYHGMNMLE-UHFFFAOYSA-N
XLogP1.32
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]propanamide?
The IUPAC name of 2-methyl-N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]propanamide (CID 45169762) is 2-methyl-N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]propanamide.
What is the SMILES notation for 2-methyl-N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]propanamide?
The canonical SMILES for 2-methyl-N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]propanamide is CC(C)C(=O)NC1CCCN(C2CCN(C)CC2)C1.
What is the InChIKey of 2-methyl-N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]propanamide?
The InChIKey is JHCDNRYHGMNMLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-12(2)15(19)16-13-5-4-8-18(11-13)14-6-9-17(3)10-7-14/h12-14H,4-11H2,1-3H3,(H,16,19).
What are the key properties of 2-methyl-N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]propanamide?
2-methyl-N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]propanamide has a molecular weight of 267.42 g/mol, XLogP of 1.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]propanamide is sourced from PubChem (CID 45169762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).