N-(2-amino-4-ethoxycyclobutyl)-2-fluoro-5-methylbenzamide

C14H19FN2O2 — CID 66196271

IUPACN-(2-amino-4-ethoxycyclobutyl)-2-fluoro-5-methylbenzamide
SMILESCCOC1CC(N)C1NC(=O)c1cc(C)ccc1F
InChIInChI=1S/C14H19FN2O2/c1-3-19-12-7-11(16)13(12)17-14(18)9-6-8(2)4-5-10(9)15/h4-6,11-13H,3,7,16H2,1-2H3,(H,17,18)
InChIKeyKIKVGKWSRSSIHE-UHFFFAOYSA-N
MW266.32 g/mol
LogP1.37
Rot. Bonds4

About N-(2-amino-4-ethoxycyclobutyl)-2-fluoro-5-methylbenzamide

N-(2-amino-4-ethoxycyclobutyl)-2-fluoro-5-methylbenzamide (PubChem CID 66196271) has the molecular formula C14H19FN2O2 and a molecular weight of 266.32 g/mol. Its IUPAC name is N-(2-amino-4-ethoxycyclobutyl)-2-fluoro-5-methylbenzamide.

Molecular Properties

Compound NameN-(2-amino-4-ethoxycyclobutyl)-2-fluoro-5-methylbenzamide
PubChem CID66196271
Molecular FormulaC14H19FN2O2
Molecular Weight266.32 g/mol
Exact Mass266.14
IUPAC NameN-(2-amino-4-ethoxycyclobutyl)-2-fluoro-5-methylbenzamide
SMILESCCOC1CC(N)C1NC(=O)c1cc(C)ccc1F
InChIInChI=1S/C14H19FN2O2/c1-3-19-12-7-11(16)13(12)17-14(18)9-6-8(2)4-5-10(9)15/h4-6,11-13H,3,7,16H2,1-2H3,(H,17,18)
InChIKeyKIKVGKWSRSSIHE-UHFFFAOYSA-N
XLogP1.37
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-4-ethoxycyclobutyl)-2,5-difluorobenzamide
CID 66197031
N-(2-amino-4-ethoxycyclobutyl)-5-chloro-2-fluorobenzamide
CID 66195304
N-(2-amino-4-ethoxycyclobutyl)-5-methyl-2-nitrobenzamide
CID 66197030
N-(2-amino-4-ethoxycyclobutyl)-2-fluoro-4-hydroxybenzamide
CID 107677163
N-(2-amino-4-ethoxycyclobutyl)-5-fluoro-2-methylbenzamide
CID 66196265
N-(2-amino-4-ethoxycyclobutyl)-2-fluoro-4-methoxybenzamide
CID 102884059
N-(2-amino-4-ethoxycyclobutyl)-2-bromo-4-chlorobenzamide
CID 107990557
N-(2-amino-4-ethoxycyclobutyl)-2-fluoro-4-nitrobenzamide
CID 66197224
N-(2-amino-4-ethoxycyclobutyl)-2,4,6-trimethylbenzamide
CID 66195481
N-(2-amino-4-ethoxycyclobutyl)-2,4-dihydroxybenzamide
CID 66195669
N-(2-amino-4-ethoxycyclobutyl)-3,6-dimethylpyridazine-4-carboxamide
CID 104671585
N-(2-amino-4-ethoxycyclobutyl)-2-bromobenzamide
CID 66195102

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-ethoxycyclobutyl)-2-fluoro-5-methylbenzamide?
The IUPAC name of N-(2-amino-4-ethoxycyclobutyl)-2-fluoro-5-methylbenzamide (CID 66196271) is N-(2-amino-4-ethoxycyclobutyl)-2-fluoro-5-methylbenzamide.
What is the SMILES notation for N-(2-amino-4-ethoxycyclobutyl)-2-fluoro-5-methylbenzamide?
The canonical SMILES for N-(2-amino-4-ethoxycyclobutyl)-2-fluoro-5-methylbenzamide is CCOC1CC(N)C1NC(=O)c1cc(C)ccc1F.
What is the InChIKey of N-(2-amino-4-ethoxycyclobutyl)-2-fluoro-5-methylbenzamide?
The InChIKey is KIKVGKWSRSSIHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O2/c1-3-19-12-7-11(16)13(12)17-14(18)9-6-8(2)4-5-10(9)15/h4-6,11-13H,3,7,16H2,1-2H3,(H,17,18).
What are the key properties of N-(2-amino-4-ethoxycyclobutyl)-2-fluoro-5-methylbenzamide?
N-(2-amino-4-ethoxycyclobutyl)-2-fluoro-5-methylbenzamide has a molecular weight of 266.32 g/mol, XLogP of 1.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-ethoxycyclobutyl)-2-fluoro-5-methylbenzamide is sourced from PubChem (CID 66196271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).