N-(4-aminocyclohexyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide

C19H27N3O2 — CID 119476626

IUPACN-(4-aminocyclohexyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
SMILESNC1CCC(NC(=O)C(c2ccccc2)N2CCCCC2=O)CC1
InChIInChI=1S/C19H27N3O2/c20-15-9-11-16(12-10-15)21-19(24)18(14-6-2-1-3-7-14)22-13-5-4-8-17(22)23/h1-3,6-7,15-16,18H,4-5,8-13,20H2,(H,21,24)
InChIKeyREHFYEAIQFVGOW-UHFFFAOYSA-N
MW329.44 g/mol
LogP2.13
Rot. Bonds4

About N-(4-aminocyclohexyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide

N-(4-aminocyclohexyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide (PubChem CID 119476626) has the molecular formula C19H27N3O2 and a molecular weight of 329.44 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
PubChem CID119476626
Molecular FormulaC19H27N3O2
Molecular Weight329.44 g/mol
Exact Mass329.21
IUPAC NameN-(4-aminocyclohexyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
SMILESNC1CCC(NC(=O)C(c2ccccc2)N2CCCCC2=O)CC1
InChIInChI=1S/C19H27N3O2/c20-15-9-11-16(12-10-15)21-19(24)18(14-6-2-1-3-7-14)22-13-5-4-8-17(22)23/h1-3,6-7,15-16,18H,4-5,8-13,20H2,(H,21,24)
InChIKeyREHFYEAIQFVGOW-UHFFFAOYSA-N
XLogP2.13
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.44
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide?
The IUPAC name of N-(4-aminocyclohexyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide (CID 119476626) is N-(4-aminocyclohexyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide?
The canonical SMILES for N-(4-aminocyclohexyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide is NC1CCC(NC(=O)C(c2ccccc2)N2CCCCC2=O)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide?
The InChIKey is REHFYEAIQFVGOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O2/c20-15-9-11-16(12-10-15)21-19(24)18(14-6-2-1-3-7-14)22-13-5-4-8-17(22)23/h1-3,6-7,15-16,18H,4-5,8-13,20H2,(H,21,24).
What are the key properties of N-(4-aminocyclohexyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide?
N-(4-aminocyclohexyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide has a molecular weight of 329.44 g/mol, XLogP of 2.13, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide is sourced from PubChem (CID 119476626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).