N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-6-methylpyridine-3-carboxamide

C16H25N3O2 — CID 71880041

IUPACN-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-6-methylpyridine-3-carboxamide
SMILESCOCCN1CCC(CNC(=O)c2ccc(C)nc2)CC1
InChIInChI=1S/C16H25N3O2/c1-13-3-4-15(12-17-13)16(20)18-11-14-5-7-19(8-6-14)9-10-21-2/h3-4,12,14H,5-11H2,1-2H3,(H,18,20)
InChIKeyANZMRFMXMWGPGT-UHFFFAOYSA-N
MW291.39 g/mol
LogP1.48
Rot. Bonds6

About N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-6-methylpyridine-3-carboxamide

N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-6-methylpyridine-3-carboxamide (PubChem CID 71880041) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-6-methylpyridine-3-carboxamide
PubChem CID71880041
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC NameN-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-6-methylpyridine-3-carboxamide
SMILESCOCCN1CCC(CNC(=O)c2ccc(C)nc2)CC1
InChIInChI=1S/C16H25N3O2/c1-13-3-4-15(12-17-13)16(20)18-11-14-5-7-19(8-6-14)9-10-21-2/h3-4,12,14H,5-11H2,1-2H3,(H,18,20)
InChIKeyANZMRFMXMWGPGT-UHFFFAOYSA-N
XLogP1.48
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-6-methylpyridine-3-carboxamide?
The IUPAC name of N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-6-methylpyridine-3-carboxamide (CID 71880041) is N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-6-methylpyridine-3-carboxamide.
What is the SMILES notation for N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-6-methylpyridine-3-carboxamide?
The canonical SMILES for N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-6-methylpyridine-3-carboxamide is COCCN1CCC(CNC(=O)c2ccc(C)nc2)CC1.
What is the InChIKey of N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-6-methylpyridine-3-carboxamide?
The InChIKey is ANZMRFMXMWGPGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-13-3-4-15(12-17-13)16(20)18-11-14-5-7-19(8-6-14)9-10-21-2/h3-4,12,14H,5-11H2,1-2H3,(H,18,20).
What are the key properties of N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-6-methylpyridine-3-carboxamide?
N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-6-methylpyridine-3-carboxamide has a molecular weight of 291.39 g/mol, XLogP of 1.48, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 71880041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).