N-(3-bromophenyl)-2-[(3-ethoxycyclobutyl)amino]acetamide

C14H19BrN2O2 — CID 103949779

IUPACN-(3-bromophenyl)-2-[(3-ethoxycyclobutyl)amino]acetamide
SMILESCCOC1CC(NCC(=O)Nc2cccc(Br)c2)C1
InChIInChI=1S/C14H19BrN2O2/c1-2-19-13-7-12(8-13)16-9-14(18)17-11-5-3-4-10(15)6-11/h3-6,12-13,16H,2,7-9H2,1H3,(H,17,18)
InChIKeyUQVYCOAXOZJYDH-UHFFFAOYSA-N
MW327.22 g/mol
LogP2.54
Rot. Bonds6

About N-(3-bromophenyl)-2-[(3-ethoxycyclobutyl)amino]acetamide

N-(3-bromophenyl)-2-[(3-ethoxycyclobutyl)amino]acetamide (PubChem CID 103949779) has the molecular formula C14H19BrN2O2 and a molecular weight of 327.22 g/mol. Its IUPAC name is N-(3-bromophenyl)-2-[(3-ethoxycyclobutyl)amino]acetamide.

Molecular Properties

Compound NameN-(3-bromophenyl)-2-[(3-ethoxycyclobutyl)amino]acetamide
PubChem CID103949779
Molecular FormulaC14H19BrN2O2
Molecular Weight327.22 g/mol
Exact Mass326.06
IUPAC NameN-(3-bromophenyl)-2-[(3-ethoxycyclobutyl)amino]acetamide
SMILESCCOC1CC(NCC(=O)Nc2cccc(Br)c2)C1
InChIInChI=1S/C14H19BrN2O2/c1-2-19-13-7-12(8-13)16-9-14(18)17-11-5-3-4-10(15)6-11/h3-6,12-13,16H,2,7-9H2,1H3,(H,17,18)
InChIKeyUQVYCOAXOZJYDH-UHFFFAOYSA-N
XLogP2.54
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.22
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3-ethoxycyclobutyl)amino]-N-phenylacetamide
CID 103921112
N-(3-bromophenyl)-2-[(3,4-dimethylcyclohexyl)amino]acetamide
CID 64742087
ethyl 3-[[2-(cyclopropylamino)acetyl]amino]benzoate
CID 61260799
N-[2-(3-bromoanilino)-2-oxoethyl]propanamide
CID 113000509
N-(3-bromophenyl)-2-[(2,3-dimethylcyclopentyl)amino]acetamide
CID 64909334
ethyl 4-[[2-(3-methylanilino)-2-oxoethyl]amino]piperidine-1-carboxylate
CID 109003606
ethyl 4-(3-bromoanilino)piperidine-1-carboxylate
CID 43762800
3-bromo-5-[[2-(3-ethoxycyclobutyl)acetyl]amino]benzoic acid
CID 103162083
N-(3-bromophenyl)-2-(diethylamino)acetamide
CID 975030
N-(3-bromophenyl)-2-[(4-hydroxycyclohexyl)methylamino]acetamide
CID 106133334
N-(3-bromophenyl)heptanamide
CID 4596383
N-(3-bromophenyl)-2-(3-methylbutylamino)acetamide
CID 28576518

Frequently Asked Questions

What is the IUPAC name of N-(3-bromophenyl)-2-[(3-ethoxycyclobutyl)amino]acetamide?
The IUPAC name of N-(3-bromophenyl)-2-[(3-ethoxycyclobutyl)amino]acetamide (CID 103949779) is N-(3-bromophenyl)-2-[(3-ethoxycyclobutyl)amino]acetamide.
What is the SMILES notation for N-(3-bromophenyl)-2-[(3-ethoxycyclobutyl)amino]acetamide?
The canonical SMILES for N-(3-bromophenyl)-2-[(3-ethoxycyclobutyl)amino]acetamide is CCOC1CC(NCC(=O)Nc2cccc(Br)c2)C1.
What is the InChIKey of N-(3-bromophenyl)-2-[(3-ethoxycyclobutyl)amino]acetamide?
The InChIKey is UQVYCOAXOZJYDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19BrN2O2/c1-2-19-13-7-12(8-13)16-9-14(18)17-11-5-3-4-10(15)6-11/h3-6,12-13,16H,2,7-9H2,1H3,(H,17,18).
What are the key properties of N-(3-bromophenyl)-2-[(3-ethoxycyclobutyl)amino]acetamide?
N-(3-bromophenyl)-2-[(3-ethoxycyclobutyl)amino]acetamide has a molecular weight of 327.22 g/mol, XLogP of 2.54, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromophenyl)-2-[(3-ethoxycyclobutyl)amino]acetamide is sourced from PubChem (CID 103949779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).