2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-4-yl)acetamide

C18H27N3O2 — CID 120798994

IUPAC2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-4-yl)acetamide
SMILESNC(C(=O)NC1CCN(c2ccccc2)CC1)C1CCOCC1
InChIInChI=1S/C18H27N3O2/c19-17(14-8-12-23-13-9-14)18(22)20-15-6-10-21(11-7-15)16-4-2-1-3-5-16/h1-5,14-15,17H,6-13,19H2,(H,20,22)
InChIKeyIXWQPXHEOYWHTR-UHFFFAOYSA-N
MW317.43 g/mol
LogP1.53
Rot. Bonds4

About 2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-4-yl)acetamide

2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-4-yl)acetamide (PubChem CID 120798994) has the molecular formula C18H27N3O2 and a molecular weight of 317.43 g/mol. Its IUPAC name is 2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-4-yl)acetamide.

Molecular Properties

Compound Name2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-4-yl)acetamide
PubChem CID120798994
Molecular FormulaC18H27N3O2
Molecular Weight317.43 g/mol
Exact Mass317.21
IUPAC Name2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-4-yl)acetamide
SMILESNC(C(=O)NC1CCN(c2ccccc2)CC1)C1CCOCC1
InChIInChI=1S/C18H27N3O2/c19-17(14-8-12-23-13-9-14)18(22)20-15-6-10-21(11-7-15)16-4-2-1-3-5-16/h1-5,14-15,17H,6-13,19H2,(H,20,22)
InChIKeyIXWQPXHEOYWHTR-UHFFFAOYSA-N
XLogP1.53
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-3-yl)acetamide;dihydrochloride
CID 120800731
2-amino-2-(oxan-4-yl)-N-[1-(3-phenylpropanoyl)piperidin-4-yl]acetamide
CID 120788504
2-amino-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-2-(oxan-4-yl)acetamide
CID 120800744
2-amino-N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(oxan-4-yl)acetamide
CID 120797554
2-amino-2-(oxan-4-yl)-N-(2-oxo-1-phenylpyrrolidin-3-yl)acetamide;hydrochloride
CID 120792867
2-amino-2-(oxan-4-yl)-N-(2-oxo-1-phenylpiperidin-3-yl)acetamide
CID 120793480
2-amino-2-(oxan-4-yl)-N-[1-(2-phenylbutanoyl)piperidin-4-yl]acetamide;hydrochloride
CID 120791093
2-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120786287
2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-2-(oxan-4-yl)acetamide
CID 120795162
2-amino-N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-2-(oxan-4-yl)acetamide;dihydrochloride
CID 120797287
2-amino-N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120791121
2-amino-2-(4-methylphenyl)-N-(1-phenylpiperidin-4-yl)acetamide
CID 120669904

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-4-yl)acetamide?
The IUPAC name of 2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-4-yl)acetamide (CID 120798994) is 2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-4-yl)acetamide.
What is the SMILES notation for 2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-4-yl)acetamide?
The canonical SMILES for 2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-4-yl)acetamide is NC(C(=O)NC1CCN(c2ccccc2)CC1)C1CCOCC1.
What is the InChIKey of 2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-4-yl)acetamide?
The InChIKey is IXWQPXHEOYWHTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O2/c19-17(14-8-12-23-13-9-14)18(22)20-15-6-10-21(11-7-15)16-4-2-1-3-5-16/h1-5,14-15,17H,6-13,19H2,(H,20,22).
What are the key properties of 2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-4-yl)acetamide?
2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-4-yl)acetamide has a molecular weight of 317.43 g/mol, XLogP of 1.53, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-4-yl)acetamide is sourced from PubChem (CID 120798994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).