4-(methoxymethyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;dihydrochloride

C14H23Cl2N3O2 — CID 120615837

IUPAC4-(methoxymethyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;dihydrochloride
SMILESCOCC1(C(=O)NCc2ccccn2)CCNCC1.Cl.Cl
InChIInChI=1S/C14H21N3O2.2ClH/c1-19-11-14(5-8-15-9-6-14)13(18)17-10-12-4-2-3-7-16-12;;/h2-4,7,15H,5-6,8-11H2,1H3,(H,17,18);2*1H
InChIKeyFRUUQVYLNNGZMJ-UHFFFAOYSA-N
MW336.26 g/mol
LogP1.56
Rot. Bonds5

About 4-(methoxymethyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;dihydrochloride

4-(methoxymethyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;dihydrochloride (PubChem CID 120615837) has the molecular formula C14H23Cl2N3O2 and a molecular weight of 336.26 g/mol. Its IUPAC name is 4-(methoxymethyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;dihydrochloride.

Molecular Properties

Compound Name4-(methoxymethyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;dihydrochloride
PubChem CID120615837
Molecular FormulaC14H23Cl2N3O2
Molecular Weight336.26 g/mol
Exact Mass335.12
IUPAC Name4-(methoxymethyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;dihydrochloride
SMILESCOCC1(C(=O)NCc2ccccn2)CCNCC1.Cl.Cl
InChIInChI=1S/C14H21N3O2.2ClH/c1-19-11-14(5-8-15-9-6-14)13(18)17-10-12-4-2-3-7-16-12;;/h2-4,7,15H,5-6,8-11H2,1H3,(H,17,18);2*1H
InChIKeyFRUUQVYLNNGZMJ-UHFFFAOYSA-N
XLogP1.56
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.26
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;dihydrochloride?
The IUPAC name of 4-(methoxymethyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;dihydrochloride (CID 120615837) is 4-(methoxymethyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;dihydrochloride.
What is the SMILES notation for 4-(methoxymethyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;dihydrochloride?
The canonical SMILES for 4-(methoxymethyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;dihydrochloride is COCC1(C(=O)NCc2ccccn2)CCNCC1.Cl.Cl.
What is the InChIKey of 4-(methoxymethyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;dihydrochloride?
The InChIKey is FRUUQVYLNNGZMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2.2ClH/c1-19-11-14(5-8-15-9-6-14)13(18)17-10-12-4-2-3-7-16-12;;/h2-4,7,15H,5-6,8-11H2,1H3,(H,17,18);2*1H.
What are the key properties of 4-(methoxymethyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;dihydrochloride?
4-(methoxymethyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;dihydrochloride has a molecular weight of 336.26 g/mol, XLogP of 1.56, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;dihydrochloride is sourced from PubChem (CID 120615837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).