2-amino-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]-2-(oxan-4-yl)acetamide

C21H33N3O2 — CID 120798822

IUPAC2-amino-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]-2-(oxan-4-yl)acetamide
SMILESCC1CCN(C(CNC(=O)C(N)C2CCOCC2)c2ccccc2)CC1
InChIInChI=1S/C21H33N3O2/c1-16-7-11-24(12-8-16)19(17-5-3-2-4-6-17)15-23-21(25)20(22)18-9-13-26-14-10-18/h2-6,16,18-20H,7-15,22H2,1H3,(H,23,25)
InChIKeySWIWVJPLNCLHRR-UHFFFAOYSA-N
MW359.51 g/mol
LogP2.33
Rot. Bonds6

About 2-amino-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]-2-(oxan-4-yl)acetamide

2-amino-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]-2-(oxan-4-yl)acetamide (PubChem CID 120798822) has the molecular formula C21H33N3O2 and a molecular weight of 359.51 g/mol. Its IUPAC name is 2-amino-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]-2-(oxan-4-yl)acetamide.

Molecular Properties

Compound Name2-amino-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]-2-(oxan-4-yl)acetamide
PubChem CID120798822
Molecular FormulaC21H33N3O2
Molecular Weight359.51 g/mol
Exact Mass359.26
IUPAC Name2-amino-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]-2-(oxan-4-yl)acetamide
SMILESCC1CCN(C(CNC(=O)C(N)C2CCOCC2)c2ccccc2)CC1
InChIInChI=1S/C21H33N3O2/c1-16-7-11-24(12-8-16)19(17-5-3-2-4-6-17)15-23-21(25)20(22)18-9-13-26-14-10-18/h2-6,16,18-20H,7-15,22H2,1H3,(H,23,25)
InChIKeySWIWVJPLNCLHRR-UHFFFAOYSA-N
XLogP2.33
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.51
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(2-morpholin-4-yl-2-phenylethyl)-2-(oxan-4-yl)acetamide
CID 120798354
2-amino-N-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]-2-(oxan-4-yl)acetamide
CID 120799806
2-amino-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-(oxan-4-yl)acetamide
CID 120796894
2-amino-N-(3,3-diphenylpropyl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120783183
2-amino-2-(oxan-4-yl)-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)acetamide;dihydrochloride
CID 120797019
(2S)-2-amino-3,3-dimethyl-N-(2-morpholin-4-yl-2-phenylethyl)butanamide
CID 119853237
2-amino-2-methyl-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]propanamide
CID 119860442
2-amino-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-2-(oxan-4-yl)acetamide
CID 120799294
2-amino-N-benzyl-2-(oxan-4-yl)acetamide
CID 120782611
N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]morpholine-3-carboxamide;dihydrochloride
CID 119860439
2-fluoro-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]benzamide
CID 112504562
3-methyl-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]benzamide
CID 112504560

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]-2-(oxan-4-yl)acetamide?
The IUPAC name of 2-amino-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]-2-(oxan-4-yl)acetamide (CID 120798822) is 2-amino-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]-2-(oxan-4-yl)acetamide.
What is the SMILES notation for 2-amino-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]-2-(oxan-4-yl)acetamide?
The canonical SMILES for 2-amino-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]-2-(oxan-4-yl)acetamide is CC1CCN(C(CNC(=O)C(N)C2CCOCC2)c2ccccc2)CC1.
What is the InChIKey of 2-amino-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]-2-(oxan-4-yl)acetamide?
The InChIKey is SWIWVJPLNCLHRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H33N3O2/c1-16-7-11-24(12-8-16)19(17-5-3-2-4-6-17)15-23-21(25)20(22)18-9-13-26-14-10-18/h2-6,16,18-20H,7-15,22H2,1H3,(H,23,25).
What are the key properties of 2-amino-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]-2-(oxan-4-yl)acetamide?
2-amino-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]-2-(oxan-4-yl)acetamide has a molecular weight of 359.51 g/mol, XLogP of 2.33, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]-2-(oxan-4-yl)acetamide is sourced from PubChem (CID 120798822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).