N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-cyclohexylbenzamide

C20H29N3O2 — CID 46687376

IUPACN-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-cyclohexylbenzamide
SMILESNC(=O)CN1CCC(NC(=O)c2ccc(C3CCCCC3)cc2)CC1
InChIInChI=1S/C20H29N3O2/c21-19(24)14-23-12-10-18(11-13-23)22-20(25)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h6-9,15,18H,1-5,10-14H2,(H2,21,24)(H,22,25)
InChIKeyAWKLBKBYIPTQSV-UHFFFAOYSA-N
MW343.47 g/mol
LogP2.41
Rot. Bonds5

About N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-cyclohexylbenzamide

N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-cyclohexylbenzamide (PubChem CID 46687376) has the molecular formula C20H29N3O2 and a molecular weight of 343.47 g/mol. Its IUPAC name is N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-cyclohexylbenzamide.

Molecular Properties

Compound NameN-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-cyclohexylbenzamide
PubChem CID46687376
Molecular FormulaC20H29N3O2
Molecular Weight343.47 g/mol
Exact Mass343.23
IUPAC NameN-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-cyclohexylbenzamide
SMILESNC(=O)CN1CCC(NC(=O)c2ccc(C3CCCCC3)cc2)CC1
InChIInChI=1S/C20H29N3O2/c21-19(24)14-23-12-10-18(11-13-23)22-20(25)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h6-9,15,18H,1-5,10-14H2,(H2,21,24)(H,22,25)
InChIKeyAWKLBKBYIPTQSV-UHFFFAOYSA-N
XLogP2.41
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.47
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-chlorobenzamide
CID 18133860
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-cyanobenzamide
CID 24674040
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-(cyclopropanecarbonylamino)benzamide
CID 134047720
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide
CID 18278929
4-cyclohexyl-N-(4-hydroxycyclohexyl)benzamide
CID 78790783
N-[1-(2-amino-2-sulfanylideneethyl)piperidin-4-yl]-4-iodobenzamide
CID 63627321
3-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]benzamide
CID 43711659
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-3-(chloromethyl)benzamide
CID 43700629
3-[4-[(4-piperidin-4-ylbenzoyl)amino]piperidin-1-yl]propanoic acid
CID 67844916
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(4-methylphenyl)-2-oxoacetamide
CID 51098486
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-5-bromopyridine-3-carboxamide
CID 53498700
4-amino-N-cyclohexylbenzamide;hydrochloride
CID 83814043

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-cyclohexylbenzamide?
The IUPAC name of N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-cyclohexylbenzamide (CID 46687376) is N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-cyclohexylbenzamide.
What is the SMILES notation for N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-cyclohexylbenzamide?
The canonical SMILES for N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-cyclohexylbenzamide is NC(=O)CN1CCC(NC(=O)c2ccc(C3CCCCC3)cc2)CC1.
What is the InChIKey of N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-cyclohexylbenzamide?
The InChIKey is AWKLBKBYIPTQSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O2/c21-19(24)14-23-12-10-18(11-13-23)22-20(25)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h6-9,15,18H,1-5,10-14H2,(H2,21,24)(H,22,25).
What are the key properties of N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-cyclohexylbenzamide?
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-cyclohexylbenzamide has a molecular weight of 343.47 g/mol, XLogP of 2.41, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-cyclohexylbenzamide is sourced from PubChem (CID 46687376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).