N-(4-chlorophenyl)-2-[(1-ethylcyclopropyl)methylamino]acetamide

C14H19ClN2O — CID 114099958

IUPACN-(4-chlorophenyl)-2-[(1-ethylcyclopropyl)methylamino]acetamide
SMILESCCC1(CNCC(=O)Nc2ccc(Cl)cc2)CC1
InChIInChI=1S/C14H19ClN2O/c1-2-14(7-8-14)10-16-9-13(18)17-12-5-3-11(15)4-6-12/h3-6,16H,2,7-10H2,1H3,(H,17,18)
InChIKeyBUTJBMQXUQEMEE-UHFFFAOYSA-N
MW266.77 g/mol
LogP3.06
Rot. Bonds6

About N-(4-chlorophenyl)-2-[(1-ethylcyclopropyl)methylamino]acetamide

N-(4-chlorophenyl)-2-[(1-ethylcyclopropyl)methylamino]acetamide (PubChem CID 114099958) has the molecular formula C14H19ClN2O and a molecular weight of 266.77 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-[(1-ethylcyclopropyl)methylamino]acetamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-[(1-ethylcyclopropyl)methylamino]acetamide
PubChem CID114099958
Molecular FormulaC14H19ClN2O
Molecular Weight266.77 g/mol
Exact Mass266.12
IUPAC NameN-(4-chlorophenyl)-2-[(1-ethylcyclopropyl)methylamino]acetamide
SMILESCCC1(CNCC(=O)Nc2ccc(Cl)cc2)CC1
InChIInChI=1S/C14H19ClN2O/c1-2-14(7-8-14)10-16-9-13(18)17-12-5-3-11(15)4-6-12/h3-6,16H,2,7-10H2,1H3,(H,17,18)
InChIKeyBUTJBMQXUQEMEE-UHFFFAOYSA-N
XLogP3.06
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.77
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chlorophenyl)-2-(2-ethylbutylamino)acetamide
CID 115592340
N-(4-chlorophenyl)-2-(2,2-dimethylbutylamino)acetamide
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CID 9032255
2-[2-(4-chlorophenyl)ethylamino]-N-(4-ethylphenyl)acetamide
CID 109002843
N-(4-chlorophenyl)-2-[(3-methyl-2-propan-2-ylbutyl)amino]acetamide
CID 102905399
N-(4-chlorophenyl)-2-[[2-ethyl-2-(hydroxymethyl)butyl]amino]acetamide
CID 106256392
N-[4-[(4-chlorophenyl)carbamoylamino]phenyl]-2-(cyclopropylmethylamino)acetamide
CID 119752578
N-(4-acetamidophenyl)-2-(4-chloroanilino)acetamide
CID 2604426
2-(butan-2-ylamino)-N-(4-chlorophenyl)acetamide
CID 43179385
2-[2-(4-chlorophenyl)ethylamino]-N-(4-methylphenyl)acetamide
CID 60647462
N-(4-chlorophenyl)-2-[(5-methylpyrazin-2-yl)methylamino]acetamide
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N,N'-bis(4-chlorophenyl)-3-oxopentanediamide
CID 12654887

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-[(1-ethylcyclopropyl)methylamino]acetamide?
The IUPAC name of N-(4-chlorophenyl)-2-[(1-ethylcyclopropyl)methylamino]acetamide (CID 114099958) is N-(4-chlorophenyl)-2-[(1-ethylcyclopropyl)methylamino]acetamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-[(1-ethylcyclopropyl)methylamino]acetamide?
The canonical SMILES for N-(4-chlorophenyl)-2-[(1-ethylcyclopropyl)methylamino]acetamide is CCC1(CNCC(=O)Nc2ccc(Cl)cc2)CC1.
What is the InChIKey of N-(4-chlorophenyl)-2-[(1-ethylcyclopropyl)methylamino]acetamide?
The InChIKey is BUTJBMQXUQEMEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O/c1-2-14(7-8-14)10-16-9-13(18)17-12-5-3-11(15)4-6-12/h3-6,16H,2,7-10H2,1H3,(H,17,18).
What are the key properties of N-(4-chlorophenyl)-2-[(1-ethylcyclopropyl)methylamino]acetamide?
N-(4-chlorophenyl)-2-[(1-ethylcyclopropyl)methylamino]acetamide has a molecular weight of 266.77 g/mol, XLogP of 3.06, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-[(1-ethylcyclopropyl)methylamino]acetamide is sourced from PubChem (CID 114099958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).