N-(3-aminooxan-4-yl)-4-(2-oxopiperidin-1-yl)benzamide

C17H23N3O3 — CID 69439191

IUPACN-(3-aminooxan-4-yl)-4-(2-oxopiperidin-1-yl)benzamide
SMILESNC1COCCC1NC(=O)c1ccc(N2CCCCC2=O)cc1
InChIInChI=1S/C17H23N3O3/c18-14-11-23-10-8-15(14)19-17(22)12-4-6-13(7-5-12)20-9-2-1-3-16(20)21/h4-7,14-15H,1-3,8-11,18H2,(H,19,22)
InChIKeyANWWCLZSAXTRQA-UHFFFAOYSA-N
MW317.39 g/mol
LogP1.05
Rot. Bonds3

About N-(3-aminooxan-4-yl)-4-(2-oxopiperidin-1-yl)benzamide

N-(3-aminooxan-4-yl)-4-(2-oxopiperidin-1-yl)benzamide (PubChem CID 69439191) has the molecular formula C17H23N3O3 and a molecular weight of 317.39 g/mol. Its IUPAC name is N-(3-aminooxan-4-yl)-4-(2-oxopiperidin-1-yl)benzamide.

Molecular Properties

Compound NameN-(3-aminooxan-4-yl)-4-(2-oxopiperidin-1-yl)benzamide
PubChem CID69439191
Molecular FormulaC17H23N3O3
Molecular Weight317.39 g/mol
Exact Mass317.17
IUPAC NameN-(3-aminooxan-4-yl)-4-(2-oxopiperidin-1-yl)benzamide
SMILESNC1COCCC1NC(=O)c1ccc(N2CCCCC2=O)cc1
InChIInChI=1S/C17H23N3O3/c18-14-11-23-10-8-15(14)19-17(22)12-4-6-13(7-5-12)20-9-2-1-3-16(20)21/h4-7,14-15H,1-3,8-11,18H2,(H,19,22)
InChIKeyANWWCLZSAXTRQA-UHFFFAOYSA-N
XLogP1.05
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-aminocyclohexyl)-4-(2-oxopyrrolidin-1-yl)benzamide
CID 69439081
N-cyclopropyl-4-(2-oxopiperidin-1-yl)benzamide
CID 18105948
N-(2-carbamoylcyclopentyl)-4-(2-oxopiperidin-1-yl)benzamide
CID 18453013
N-[(3S,4R)-3-hydroxyoxan-4-yl]-4-pyrrolidin-1-ylbenzamide
CID 91761594
N-[4-(3-chloroindol-1-yl)oxan-3-yl]-4-(2-oxopiperidin-1-yl)benzamide
CID 90951589
5-chloro-N-[(3R,4S)-4-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]oxolan-3-yl]thiophene-2-carboxamide
CID 90891307
N-methoxy-4-(2-oxopiperidin-1-yl)benzamide
CID 51279408
N-(2-aminocyclopentyl)-2-fluoro-4-(2-oxopiperidin-1-yl)benzamide
CID 69440309
N-[(3S,4R)-3-hydroxyoxan-4-yl]-4-(4-methylpiperazin-1-yl)benzamide
CID 91766537
3-[oxan-4-yl-[4-(2-oxopiperidin-1-yl)benzoyl]amino]propanoic acid
CID 119212255
N-(2-methylpropyl)-4-(2-oxopiperidin-1-yl)benzamide
CID 18106043
3-chloro-N-[2-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]cyclopentyl]-1H-indole-6-carboxamide
CID 11641494

Frequently Asked Questions

What is the IUPAC name of N-(3-aminooxan-4-yl)-4-(2-oxopiperidin-1-yl)benzamide?
The IUPAC name of N-(3-aminooxan-4-yl)-4-(2-oxopiperidin-1-yl)benzamide (CID 69439191) is N-(3-aminooxan-4-yl)-4-(2-oxopiperidin-1-yl)benzamide.
What is the SMILES notation for N-(3-aminooxan-4-yl)-4-(2-oxopiperidin-1-yl)benzamide?
The canonical SMILES for N-(3-aminooxan-4-yl)-4-(2-oxopiperidin-1-yl)benzamide is NC1COCCC1NC(=O)c1ccc(N2CCCCC2=O)cc1.
What is the InChIKey of N-(3-aminooxan-4-yl)-4-(2-oxopiperidin-1-yl)benzamide?
The InChIKey is ANWWCLZSAXTRQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O3/c18-14-11-23-10-8-15(14)19-17(22)12-4-6-13(7-5-12)20-9-2-1-3-16(20)21/h4-7,14-15H,1-3,8-11,18H2,(H,19,22).
What are the key properties of N-(3-aminooxan-4-yl)-4-(2-oxopiperidin-1-yl)benzamide?
N-(3-aminooxan-4-yl)-4-(2-oxopiperidin-1-yl)benzamide has a molecular weight of 317.39 g/mol, XLogP of 1.05, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminooxan-4-yl)-4-(2-oxopiperidin-1-yl)benzamide is sourced from PubChem (CID 69439191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).