2-(dimethylamino)-N-[2-(4-methylpiperidin-1-yl)propyl]-2-phenylacetamide

C19H31N3O — CID 110620673

IUPAC2-(dimethylamino)-N-[2-(4-methylpiperidin-1-yl)propyl]-2-phenylacetamide
SMILESCC1CCN(C(C)CNC(=O)C(c2ccccc2)N(C)C)CC1
InChIInChI=1S/C19H31N3O/c1-15-10-12-22(13-11-15)16(2)14-20-19(23)18(21(3)4)17-8-6-5-7-9-17/h5-9,15-16,18H,10-14H2,1-4H3,(H,20,23)
InChIKeyXDIFZPDBIKRFQB-UHFFFAOYSA-N
MW317.48 g/mol
LogP2.53
Rot. Bonds6

About 2-(dimethylamino)-N-[2-(4-methylpiperidin-1-yl)propyl]-2-phenylacetamide

2-(dimethylamino)-N-[2-(4-methylpiperidin-1-yl)propyl]-2-phenylacetamide (PubChem CID 110620673) has the molecular formula C19H31N3O and a molecular weight of 317.48 g/mol. Its IUPAC name is 2-(dimethylamino)-N-[2-(4-methylpiperidin-1-yl)propyl]-2-phenylacetamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-[2-(4-methylpiperidin-1-yl)propyl]-2-phenylacetamide
PubChem CID110620673
Molecular FormulaC19H31N3O
Molecular Weight317.48 g/mol
Exact Mass317.25
IUPAC Name2-(dimethylamino)-N-[2-(4-methylpiperidin-1-yl)propyl]-2-phenylacetamide
SMILESCC1CCN(C(C)CNC(=O)C(c2ccccc2)N(C)C)CC1
InChIInChI=1S/C19H31N3O/c1-15-10-12-22(13-11-15)16(2)14-20-19(23)18(21(3)4)17-8-6-5-7-9-17/h5-9,15-16,18H,10-14H2,1-4H3,(H,20,23)
InChIKeyXDIFZPDBIKRFQB-UHFFFAOYSA-N
XLogP2.53
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.48
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-methylpiperidin-1-yl)propyl]benzamide
CID 112502434
2-(dimethylamino)-2-phenyl-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide
CID 47839657
(2R)-2-(dimethylamino)-2-phenyl-N-[(2R)-2-phenylpropyl]acetamide
CID 99645937
1-benzoyl-N-[2-(4-methylpiperidin-1-yl)propyl]piperidine-4-carboxamide
CID 110301812
2-[3-(hydroxymethyl)phenoxy]-N-[2-(4-methylpiperidin-1-yl)propyl]propanamide
CID 109388933
(2R)-N-(cyclohexylmethyl)-2-(dimethylamino)-2-phenylacetamide
CID 100566223
2-(dimethylamino)-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]-2-phenylacetamide
CID 110621774
(2R)-2-(dimethylamino)-N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2-phenylacetamide
CID 94956250
2-(methylamino)-N-[2-(4-methylpiperidin-1-yl)propyl]acetamide
CID 120704077
4-(2-chlorophenyl)-N-[2-(4-methylpiperidin-1-yl)propyl]-4-oxobutanamide
CID 110620731
2-(2-methoxyphenoxy)-N-[2-(4-methylpiperidin-1-yl)propyl]acetamide
CID 112502471
3-amino-2-methyl-N-[2-(3-methylpiperidin-1-yl)propyl]-3-phenylpropanamide
CID 119850745

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-[2-(4-methylpiperidin-1-yl)propyl]-2-phenylacetamide?
The IUPAC name of 2-(dimethylamino)-N-[2-(4-methylpiperidin-1-yl)propyl]-2-phenylacetamide (CID 110620673) is 2-(dimethylamino)-N-[2-(4-methylpiperidin-1-yl)propyl]-2-phenylacetamide.
What is the SMILES notation for 2-(dimethylamino)-N-[2-(4-methylpiperidin-1-yl)propyl]-2-phenylacetamide?
The canonical SMILES for 2-(dimethylamino)-N-[2-(4-methylpiperidin-1-yl)propyl]-2-phenylacetamide is CC1CCN(C(C)CNC(=O)C(c2ccccc2)N(C)C)CC1.
What is the InChIKey of 2-(dimethylamino)-N-[2-(4-methylpiperidin-1-yl)propyl]-2-phenylacetamide?
The InChIKey is XDIFZPDBIKRFQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N3O/c1-15-10-12-22(13-11-15)16(2)14-20-19(23)18(21(3)4)17-8-6-5-7-9-17/h5-9,15-16,18H,10-14H2,1-4H3,(H,20,23).
What are the key properties of 2-(dimethylamino)-N-[2-(4-methylpiperidin-1-yl)propyl]-2-phenylacetamide?
2-(dimethylamino)-N-[2-(4-methylpiperidin-1-yl)propyl]-2-phenylacetamide has a molecular weight of 317.48 g/mol, XLogP of 2.53, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-[2-(4-methylpiperidin-1-yl)propyl]-2-phenylacetamide is sourced from PubChem (CID 110620673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).