4-ethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide

C15H29N3O — CID 114428843

IUPAC4-ethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NCC2CCN(C)CC2)C1
InChIInChI=1S/C15H29N3O/c1-3-12-4-7-16-14(10-12)15(19)17-11-13-5-8-18(2)9-6-13/h12-14,16H,3-11H2,1-2H3,(H,17,19)
InChIKeyNPMCIUJCNSFBLW-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.22
Rot. Bonds4

About 4-ethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide

4-ethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide (PubChem CID 114428843) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 4-ethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide
PubChem CID114428843
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name4-ethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NCC2CCN(C)CC2)C1
InChIInChI=1S/C15H29N3O/c1-3-12-4-7-16-14(10-12)15(19)17-11-13-5-8-18(2)9-6-13/h12-14,16H,3-11H2,1-2H3,(H,17,19)
InChIKeyNPMCIUJCNSFBLW-UHFFFAOYSA-N
XLogP1.22
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide?
The IUPAC name of 4-ethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide (CID 114428843) is 4-ethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide.
What is the SMILES notation for 4-ethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide?
The canonical SMILES for 4-ethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide is CCC1CCNC(C(=O)NCC2CCN(C)CC2)C1.
What is the InChIKey of 4-ethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide?
The InChIKey is NPMCIUJCNSFBLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-3-12-4-7-16-14(10-12)15(19)17-11-13-5-8-18(2)9-6-13/h12-14,16H,3-11H2,1-2H3,(H,17,19).
What are the key properties of 4-ethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide?
4-ethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide has a molecular weight of 267.42 g/mol, XLogP of 1.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide is sourced from PubChem (CID 114428843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).