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

C14H20N2O3 — CID 114632319

IUPACN-(3-amino-2,2-dimethylcyclobutyl)-2-hydroxy-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2CC(N)C2(C)C)c(O)c1
InChIInChI=1S/C14H20N2O3/c1-14(2)11(15)7-12(14)16-13(18)9-5-4-8(19-3)6-10(9)17/h4-6,11-12,17H,7,15H2,1-3H3,(H,16,18)
InChIKeyRRKZKFNORQSOAM-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.26
Rot. Bonds3

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

N-(3-amino-2,2-dimethylcyclobutyl)-2-hydroxy-4-methoxybenzamide (PubChem CID 114632319) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is N-(3-amino-2,2-dimethylcyclobutyl)-2-hydroxy-4-methoxybenzamide.

Molecular Properties

Compound NameN-(3-amino-2,2-dimethylcyclobutyl)-2-hydroxy-4-methoxybenzamide
PubChem CID114632319
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC NameN-(3-amino-2,2-dimethylcyclobutyl)-2-hydroxy-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2CC(N)C2(C)C)c(O)c1
InChIInChI=1S/C14H20N2O3/c1-14(2)11(15)7-12(14)16-13(18)9-5-4-8(19-3)6-10(9)17/h4-6,11-12,17H,7,15H2,1-3H3,(H,16,18)
InChIKeyRRKZKFNORQSOAM-UHFFFAOYSA-N
XLogP1.26
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-aminocyclopropyl)-2-hydroxy-4-methoxybenzamide
CID 43593875
2-hydroxy-4-methoxy-N-(2,2,3,3-tetramethylcyclopropyl)benzamide
CID 79351166
N-(2,2-dimethylcyclohexyl)-2-hydroxy-4-methoxybenzamide
CID 79877931
2-hydroxy-4-methoxy-N-(3-methylcyclobutyl)benzamide
CID 115671067
2-[(2-hydroxy-4-methoxybenzoyl)amino]-1-methylcyclopentane-1-carboxylic acid
CID 82765367
N-(3,3-dimethylcyclopentyl)-2-hydroxy-4-methoxybenzamide
CID 115881718
N-(3-amino-2,2-dimethylcyclobutyl)-3,4-dihydroxybenzamide
CID 107727566
N-(3-amino-2,2-dimethylcyclobutyl)-3,4-dimethoxybenzamide
CID 114632315
2-hydroxy-4-methoxy-N-(oxan-4-yl)benzamide
CID 43610298
2-hydroxy-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methoxybenzamide
CID 104956910
2-hydroxy-4-methoxy-N-(1-methylcyclobutyl)benzamide
CID 113346628
N-(dicyclopropylmethyl)-2-hydroxy-4-methoxybenzamide
CID 60717998

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-dimethylcyclobutyl)-2-hydroxy-4-methoxybenzamide?
The IUPAC name of N-(3-amino-2,2-dimethylcyclobutyl)-2-hydroxy-4-methoxybenzamide (CID 114632319) is N-(3-amino-2,2-dimethylcyclobutyl)-2-hydroxy-4-methoxybenzamide.
What is the SMILES notation for N-(3-amino-2,2-dimethylcyclobutyl)-2-hydroxy-4-methoxybenzamide?
The canonical SMILES for N-(3-amino-2,2-dimethylcyclobutyl)-2-hydroxy-4-methoxybenzamide is COc1ccc(C(=O)NC2CC(N)C2(C)C)c(O)c1.
What is the InChIKey of N-(3-amino-2,2-dimethylcyclobutyl)-2-hydroxy-4-methoxybenzamide?
The InChIKey is RRKZKFNORQSOAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-14(2)11(15)7-12(14)16-13(18)9-5-4-8(19-3)6-10(9)17/h4-6,11-12,17H,7,15H2,1-3H3,(H,16,18).
What are the key properties of N-(3-amino-2,2-dimethylcyclobutyl)-2-hydroxy-4-methoxybenzamide?
N-(3-amino-2,2-dimethylcyclobutyl)-2-hydroxy-4-methoxybenzamide has a molecular weight of 264.32 g/mol, XLogP of 1.26, 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-dimethylcyclobutyl)-2-hydroxy-4-methoxybenzamide is sourced from PubChem (CID 114632319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).