N-(2-aminoethyl)-2-(2-chlorophenyl)acetamide

C10H13ClN2O — CID 12841728

IUPACN-(2-aminoethyl)-2-(2-chlorophenyl)acetamide
SMILESNCCNC(=O)Cc1ccccc1Cl
InChIInChI=1S/C10H13ClN2O/c11-9-4-2-1-3-8(9)7-10(14)13-6-5-12/h1-4H,5-7,12H2,(H,13,14)
InChIKeyIPQULDXQMKOLKL-UHFFFAOYSA-N
MW212.68 g/mol
LogP0.96
Rot. Bonds4

About N-(2-aminoethyl)-2-(2-chlorophenyl)acetamide

N-(2-aminoethyl)-2-(2-chlorophenyl)acetamide (PubChem CID 12841728) has the molecular formula C10H13ClN2O and a molecular weight of 212.68 g/mol. Its IUPAC name is N-(2-aminoethyl)-2-(2-chlorophenyl)acetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-2-(2-chlorophenyl)acetamide
PubChem CID12841728
Molecular FormulaC10H13ClN2O
Molecular Weight212.68 g/mol
Exact Mass212.07
IUPAC NameN-(2-aminoethyl)-2-(2-chlorophenyl)acetamide
SMILESNCCNC(=O)Cc1ccccc1Cl
InChIInChI=1S/C10H13ClN2O/c11-9-4-2-1-3-8(9)7-10(14)13-6-5-12/h1-4H,5-7,12H2,(H,13,14)
InChIKeyIPQULDXQMKOLKL-UHFFFAOYSA-N
XLogP0.96
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.68
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-aminoethyl)-2-[(2-chlorophenyl)methylsulfonyl]acetamide
CID 103291290
3-amino-N-[2-(2-chlorophenyl)ethyl]propanamide
CID 94684846
N-[2-(4-aminophenyl)ethyl]-2-(2-chlorophenyl)acetamide
CID 61219066
N-[2-[[2-(2-chlorophenyl)acetyl]amino]ethyl]-2,2,2-trifluoroacetamide
CID 108932586
2-(2-chlorophenyl)-N-[2-(N-methylanilino)ethyl]acetamide
CID 94476681
2-(2-chlorophenyl)-N-(3-cyanopropyl)acetamide
CID 62665870
N-(3-aminopropyl)-3-(2-chlorophenyl)propanamide
CID 94687820
2-(2-chlorophenyl)-N-pent-3-ynylacetamide
CID 115977322
N-(4-amino-4-hydroxyiminobutyl)-2-(2-chlorophenyl)acetamide
CID 76953220
2-(2-chlorophenyl)-N-(2-oxopropyl)acetamide
CID 64996556
4-amino-N-[(2-chlorophenyl)methyl]butanamide
CID 22692149
4-amino-N-[2-(2-chlorophenyl)ethyl]butanamide;hydrochloride
CID 44818079

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2-(2-chlorophenyl)acetamide?
The IUPAC name of N-(2-aminoethyl)-2-(2-chlorophenyl)acetamide (CID 12841728) is N-(2-aminoethyl)-2-(2-chlorophenyl)acetamide.
What is the SMILES notation for N-(2-aminoethyl)-2-(2-chlorophenyl)acetamide?
The canonical SMILES for N-(2-aminoethyl)-2-(2-chlorophenyl)acetamide is NCCNC(=O)Cc1ccccc1Cl.
What is the InChIKey of N-(2-aminoethyl)-2-(2-chlorophenyl)acetamide?
The InChIKey is IPQULDXQMKOLKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O/c11-9-4-2-1-3-8(9)7-10(14)13-6-5-12/h1-4H,5-7,12H2,(H,13,14).
What are the key properties of N-(2-aminoethyl)-2-(2-chlorophenyl)acetamide?
N-(2-aminoethyl)-2-(2-chlorophenyl)acetamide has a molecular weight of 212.68 g/mol, XLogP of 0.96, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-2-(2-chlorophenyl)acetamide is sourced from PubChem (CID 12841728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).