N-(2-chlorophenyl)-2-[cyclopropyl-(1-ethylpiperidin-4-yl)amino]acetamide

C18H26ClN3O — CID 75393855

IUPACN-(2-chlorophenyl)-2-[cyclopropyl-(1-ethylpiperidin-4-yl)amino]acetamide
SMILESCCN1CCC(N(CC(=O)Nc2ccccc2Cl)C2CC2)CC1
InChIInChI=1S/C18H26ClN3O/c1-2-21-11-9-15(10-12-21)22(14-7-8-14)13-18(23)20-17-6-4-3-5-16(17)19/h3-6,14-15H,2,7-13H2,1H3,(H,20,23)
InChIKeyAPUADAASXZGMMG-UHFFFAOYSA-N
MW335.88 g/mol
LogP3.23
Rot. Bonds6

About N-(2-chlorophenyl)-2-[cyclopropyl-(1-ethylpiperidin-4-yl)amino]acetamide

N-(2-chlorophenyl)-2-[cyclopropyl-(1-ethylpiperidin-4-yl)amino]acetamide (PubChem CID 75393855) has the molecular formula C18H26ClN3O and a molecular weight of 335.88 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-[cyclopropyl-(1-ethylpiperidin-4-yl)amino]acetamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-[cyclopropyl-(1-ethylpiperidin-4-yl)amino]acetamide
PubChem CID75393855
Molecular FormulaC18H26ClN3O
Molecular Weight335.88 g/mol
Exact Mass335.18
IUPAC NameN-(2-chlorophenyl)-2-[cyclopropyl-(1-ethylpiperidin-4-yl)amino]acetamide
SMILESCCN1CCC(N(CC(=O)Nc2ccccc2Cl)C2CC2)CC1
InChIInChI=1S/C18H26ClN3O/c1-2-21-11-9-15(10-12-21)22(14-7-8-14)13-18(23)20-17-6-4-3-5-16(17)19/h3-6,14-15H,2,7-13H2,1H3,(H,20,23)
InChIKeyAPUADAASXZGMMG-UHFFFAOYSA-N
XLogP3.23
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.88
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-acetylphenyl)-2-[(1-ethylpiperidin-4-yl)-methylamino]acetamide
CID 86920663
3-(2-chlorophenyl)-1-(1-ethylpiperidin-4-yl)-1-[(4-fluorophenyl)methyl]urea
CID 6625876
ethyl 1-[2-[[2-(2-chloroanilino)-2-oxoethyl]-methylamino]-2-oxoethyl]piperidine-4-carboxylate
CID 8931239
1-(2-chlorophenyl)-3-(1-ethylpiperidin-4-yl)thiourea
CID 17282493
N-(2-chlorophenyl)-2-[2-[cyclopropyl(methyl)amino]ethylamino]acetamide
CID 55140260
N-(2-chlorophenyl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]acetamide
CID 11971646
2-[azetidin-3-yl(ethyl)amino]-N-(2-chlorophenyl)acetamide
CID 66183463
2-[4-(1-aminoethyl)piperidin-1-yl]-N-(2-chlorophenyl)acetamide;hydrochloride
CID 119920864
3-(4-aminopiperidin-1-yl)-N-(2-chlorophenyl)propanamide
CID 43556671
methyl 1-[2-(2-chloroanilino)-2-oxoethyl]pyrrolidine-3-carboxylate
CID 47287034
N-(2-chlorophenyl)-2-(3,9-diazabicyclo[4.2.1]nonan-3-yl)acetamide
CID 81491367
2-[benzyl(2-pyrrolidin-1-ylethyl)amino]-N-(2-chlorophenyl)acetamide;dihydrochloride
CID 11971642

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-[cyclopropyl-(1-ethylpiperidin-4-yl)amino]acetamide?
The IUPAC name of N-(2-chlorophenyl)-2-[cyclopropyl-(1-ethylpiperidin-4-yl)amino]acetamide (CID 75393855) is N-(2-chlorophenyl)-2-[cyclopropyl-(1-ethylpiperidin-4-yl)amino]acetamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-[cyclopropyl-(1-ethylpiperidin-4-yl)amino]acetamide?
The canonical SMILES for N-(2-chlorophenyl)-2-[cyclopropyl-(1-ethylpiperidin-4-yl)amino]acetamide is CCN1CCC(N(CC(=O)Nc2ccccc2Cl)C2CC2)CC1.
What is the InChIKey of N-(2-chlorophenyl)-2-[cyclopropyl-(1-ethylpiperidin-4-yl)amino]acetamide?
The InChIKey is APUADAASXZGMMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26ClN3O/c1-2-21-11-9-15(10-12-21)22(14-7-8-14)13-18(23)20-17-6-4-3-5-16(17)19/h3-6,14-15H,2,7-13H2,1H3,(H,20,23).
What are the key properties of N-(2-chlorophenyl)-2-[cyclopropyl-(1-ethylpiperidin-4-yl)amino]acetamide?
N-(2-chlorophenyl)-2-[cyclopropyl-(1-ethylpiperidin-4-yl)amino]acetamide has a molecular weight of 335.88 g/mol, XLogP of 3.23, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-[cyclopropyl-(1-ethylpiperidin-4-yl)amino]acetamide is sourced from PubChem (CID 75393855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).