N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-3-hydroxy-4-methoxybenzamide

C16H24N2O3 — CID 79735299

IUPACN-(3-amino-2,2,4,4-tetramethylcyclobutyl)-3-hydroxy-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2C(C)(C)C(N)C2(C)C)cc1O
InChIInChI=1S/C16H24N2O3/c1-15(2)13(17)16(3,4)14(15)18-12(20)9-6-7-11(21-5)10(19)8-9/h6-8,13-14,19H,17H2,1-5H3,(H,18,20)
InChIKeyMQSXXTDIITZPAB-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.89
Rot. Bonds3

About N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-3-hydroxy-4-methoxybenzamide

N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-3-hydroxy-4-methoxybenzamide (PubChem CID 79735299) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-3-hydroxy-4-methoxybenzamide.

Molecular Properties

Compound NameN-(3-amino-2,2,4,4-tetramethylcyclobutyl)-3-hydroxy-4-methoxybenzamide
PubChem CID79735299
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC NameN-(3-amino-2,2,4,4-tetramethylcyclobutyl)-3-hydroxy-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2C(C)(C)C(N)C2(C)C)cc1O
InChIInChI=1S/C16H24N2O3/c1-15(2)13(17)16(3,4)14(15)18-12(20)9-6-7-11(21-5)10(19)8-9/h6-8,13-14,19H,17H2,1-5H3,(H,18,20)
InChIKeyMQSXXTDIITZPAB-UHFFFAOYSA-N
XLogP1.89
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-3-fluoro-4-methoxybenzamide
CID 79698755
N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-3,4-dihydroxybenzamide
CID 107728779
N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-5-chloro-2-methoxybenzamide
CID 79698778
N-cyclohexyl-3-hydroxy-4-methoxybenzamide
CID 79600190
N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-4-chlorobenzamide
CID 79710945
N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-1,3-dihydro-2-benzofuran-5-carboxamide
CID 79698757
3-hydroxy-4-methoxybenzoic acid
CID 12575
3-hydroxy-4-methoxy-N-piperidin-4-ylbenzamide
CID 79725951
N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-4-ethylbenzamide
CID 79711984
N-[(2,2-dimethylcyclopropyl)methyl]-3-hydroxy-4-methoxybenzamide
CID 103728984
N-(3-amino-2,2-dimethylcyclobutyl)-3,4-dimethoxybenzamide
CID 114632315
N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-1H-indole-5-carboxamide
CID 79698493

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-3-hydroxy-4-methoxybenzamide?
The IUPAC name of N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-3-hydroxy-4-methoxybenzamide (CID 79735299) is N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-3-hydroxy-4-methoxybenzamide.
What is the SMILES notation for N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-3-hydroxy-4-methoxybenzamide?
The canonical SMILES for N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-3-hydroxy-4-methoxybenzamide is COc1ccc(C(=O)NC2C(C)(C)C(N)C2(C)C)cc1O.
What is the InChIKey of N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-3-hydroxy-4-methoxybenzamide?
The InChIKey is MQSXXTDIITZPAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-15(2)13(17)16(3,4)14(15)18-12(20)9-6-7-11(21-5)10(19)8-9/h6-8,13-14,19H,17H2,1-5H3,(H,18,20).
What are the key properties of N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-3-hydroxy-4-methoxybenzamide?
N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-3-hydroxy-4-methoxybenzamide has a molecular weight of 292.38 g/mol, XLogP of 1.89, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-3-hydroxy-4-methoxybenzamide is sourced from PubChem (CID 79735299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).