N-methyl-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-N-phenylacetamide

C19H29N3O2 — CID 60503563

IUPACN-methyl-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-N-phenylacetamide
SMILESCN(C(=O)CN1CCC(CN2CCOCC2)CC1)c1ccccc1
InChIInChI=1S/C19H29N3O2/c1-20(18-5-3-2-4-6-18)19(23)16-21-9-7-17(8-10-21)15-22-11-13-24-14-12-22/h2-6,17H,7-16H2,1H3
InChIKeyYORKMRXFFNDROK-UHFFFAOYSA-N
MW331.46 g/mol
LogP1.69
Rot. Bonds5

About N-methyl-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-N-phenylacetamide

N-methyl-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-N-phenylacetamide (PubChem CID 60503563) has the molecular formula C19H29N3O2 and a molecular weight of 331.46 g/mol. Its IUPAC name is N-methyl-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-N-phenylacetamide.

Molecular Properties

Compound NameN-methyl-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-N-phenylacetamide
PubChem CID60503563
Molecular FormulaC19H29N3O2
Molecular Weight331.46 g/mol
Exact Mass331.23
IUPAC NameN-methyl-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-N-phenylacetamide
SMILESCN(C(=O)CN1CCC(CN2CCOCC2)CC1)c1ccccc1
InChIInChI=1S/C19H29N3O2/c1-20(18-5-3-2-4-6-18)19(23)16-21-9-7-17(8-10-21)15-22-11-13-24-14-12-22/h2-6,17H,7-16H2,1H3
InChIKeyYORKMRXFFNDROK-UHFFFAOYSA-N
XLogP1.69
TPSA36.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.46
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-N-phenylacetamide?
The IUPAC name of N-methyl-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-N-phenylacetamide (CID 60503563) is N-methyl-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-N-phenylacetamide.
What is the SMILES notation for N-methyl-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-N-phenylacetamide?
The canonical SMILES for N-methyl-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-N-phenylacetamide is CN(C(=O)CN1CCC(CN2CCOCC2)CC1)c1ccccc1.
What is the InChIKey of N-methyl-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-N-phenylacetamide?
The InChIKey is YORKMRXFFNDROK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O2/c1-20(18-5-3-2-4-6-18)19(23)16-21-9-7-17(8-10-21)15-22-11-13-24-14-12-22/h2-6,17H,7-16H2,1H3.
What are the key properties of N-methyl-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-N-phenylacetamide?
N-methyl-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-N-phenylacetamide has a molecular weight of 331.46 g/mol, XLogP of 1.69, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-N-phenylacetamide is sourced from PubChem (CID 60503563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).