N-(3-chlorophenyl)-2-[(2-cyclopropyl-2-hydroxyethyl)amino]acetamide

C13H17ClN2O2 — CID 63298595

IUPACN-(3-chlorophenyl)-2-[(2-cyclopropyl-2-hydroxyethyl)amino]acetamide
SMILESO=C(CNCC(O)C1CC1)Nc1cccc(Cl)c1
InChIInChI=1S/C13H17ClN2O2/c14-10-2-1-3-11(6-10)16-13(18)8-15-7-12(17)9-4-5-9/h1-3,6,9,12,15,17H,4-5,7-8H2,(H,16,18)
InChIKeyZDMWITHOFZXGKD-UHFFFAOYSA-N
MW268.74 g/mol
LogP1.64
Rot. Bonds6

About N-(3-chlorophenyl)-2-[(2-cyclopropyl-2-hydroxyethyl)amino]acetamide

N-(3-chlorophenyl)-2-[(2-cyclopropyl-2-hydroxyethyl)amino]acetamide (PubChem CID 63298595) has the molecular formula C13H17ClN2O2 and a molecular weight of 268.74 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-[(2-cyclopropyl-2-hydroxyethyl)amino]acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-[(2-cyclopropyl-2-hydroxyethyl)amino]acetamide
PubChem CID63298595
Molecular FormulaC13H17ClN2O2
Molecular Weight268.74 g/mol
Exact Mass268.10
IUPAC NameN-(3-chlorophenyl)-2-[(2-cyclopropyl-2-hydroxyethyl)amino]acetamide
SMILESO=C(CNCC(O)C1CC1)Nc1cccc(Cl)c1
InChIInChI=1S/C13H17ClN2O2/c14-10-2-1-3-11(6-10)16-13(18)8-15-7-12(17)9-4-5-9/h1-3,6,9,12,15,17H,4-5,7-8H2,(H,16,18)
InChIKeyZDMWITHOFZXGKD-UHFFFAOYSA-N
XLogP1.64
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.74
LogP ≤ 51.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chlorophenyl)-2-(2,3-dihydroxypropylamino)acetamide
CID 66171426
N-(3-chlorophenyl)-2-(1-cyclopropylethylamino)acetamide
CID 43401773
1-(3-chlorophenyl)-3-(2-cyclohexyl-2-hydroxyethyl)urea
CID 90498971
N-(3-chlorophenyl)-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]acetamide
CID 115745385
N-(3-chlorophenyl)-2-(cycloheptylamino)acetamide
CID 43236492
N-(3-chlorophenyl)-2-(2,2-dimethylpropylamino)acetamide
CID 61168620
N-[2-(3-chloroanilino)-2-oxoethyl]cyclobutanecarboxamide
CID 112997859
N-(3-chlorophenyl)-2-(5-hydroxypentylamino)acetamide
CID 103820250
2-(3-chloroanilino)-N-(3,5-dichlorophenyl)acetamide
CID 54809235
N-(3-chlorophenyl)-2-(2-pyrrolidin-1-ylethylamino)acetamide
CID 55023239
N-(3-chlorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide
CID 46602371
N-(3-chlorophenyl)-2-[(2-methyloxolan-3-yl)amino]acetamide
CID 82726082

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-[(2-cyclopropyl-2-hydroxyethyl)amino]acetamide?
The IUPAC name of N-(3-chlorophenyl)-2-[(2-cyclopropyl-2-hydroxyethyl)amino]acetamide (CID 63298595) is N-(3-chlorophenyl)-2-[(2-cyclopropyl-2-hydroxyethyl)amino]acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-[(2-cyclopropyl-2-hydroxyethyl)amino]acetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-[(2-cyclopropyl-2-hydroxyethyl)amino]acetamide is O=C(CNCC(O)C1CC1)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-2-[(2-cyclopropyl-2-hydroxyethyl)amino]acetamide?
The InChIKey is ZDMWITHOFZXGKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17ClN2O2/c14-10-2-1-3-11(6-10)16-13(18)8-15-7-12(17)9-4-5-9/h1-3,6,9,12,15,17H,4-5,7-8H2,(H,16,18).
What are the key properties of N-(3-chlorophenyl)-2-[(2-cyclopropyl-2-hydroxyethyl)amino]acetamide?
N-(3-chlorophenyl)-2-[(2-cyclopropyl-2-hydroxyethyl)amino]acetamide has a molecular weight of 268.74 g/mol, XLogP of 1.64, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-[(2-cyclopropyl-2-hydroxyethyl)amino]acetamide is sourced from PubChem (CID 63298595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).