N-[2-[cyclopropyl(methyl)amino]ethyl]-3-hydroxy-4-methoxybenzamide

C14H20N2O3 — CID 79673447

IUPACN-[2-[cyclopropyl(methyl)amino]ethyl]-3-hydroxy-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NCCN(C)C2CC2)cc1O
InChIInChI=1S/C14H20N2O3/c1-16(11-4-5-11)8-7-15-14(18)10-3-6-13(19-2)12(17)9-10/h3,6,9,11,17H,4-5,7-8H2,1-2H3,(H,15,18)
InChIKeySAFYEFKKLDYMIS-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.22
Rot. Bonds6

About N-[2-[cyclopropyl(methyl)amino]ethyl]-3-hydroxy-4-methoxybenzamide

N-[2-[cyclopropyl(methyl)amino]ethyl]-3-hydroxy-4-methoxybenzamide (PubChem CID 79673447) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is N-[2-[cyclopropyl(methyl)amino]ethyl]-3-hydroxy-4-methoxybenzamide.

Molecular Properties

Compound NameN-[2-[cyclopropyl(methyl)amino]ethyl]-3-hydroxy-4-methoxybenzamide
PubChem CID79673447
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC NameN-[2-[cyclopropyl(methyl)amino]ethyl]-3-hydroxy-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NCCN(C)C2CC2)cc1O
InChIInChI=1S/C14H20N2O3/c1-16(11-4-5-11)8-7-15-14(18)10-3-6-13(19-2)12(17)9-10/h3,6,9,11,17H,4-5,7-8H2,1-2H3,(H,15,18)
InChIKeySAFYEFKKLDYMIS-UHFFFAOYSA-N
XLogP1.22
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[cyclopentyl(methyl)amino]ethyl]-3,4-dihydroxybenzamide
CID 103956034
N-[2-[acetyl(cyclopropyl)amino]ethyl]-3,4-dimethoxybenzamide
CID 113052128
3-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-4-methylbenzamide
CID 62059516
N-[2-[cyclopentyl(methyl)amino]ethyl]-3-hydroxy-4-iodobenzamide
CID 104628315
5-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-methoxybenzamide
CID 62975328
N-[2-[cyclopropyl(methyl)amino]ethyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
CID 104614971
N-ethyl-3-hydroxy-4-methoxybenzamide
CID 79600193
3-hydroxy-4-methoxy-N-(3-methylbutyl)benzamide
CID 79600016
N-[2-(ethylamino)ethyl]-3-hydroxy-4-methoxybenzamide
CID 79733239
N-[(2,2-dimethylcyclopropyl)methyl]-3-hydroxy-4-methoxybenzamide
CID 103728984
3-hydroxy-4-methoxy-N-[2-(propylamino)ethyl]benzamide
CID 79733240
N-[2-(cyclopropylamino)-2-oxoethyl]-3-hydroxy-4-methoxybenzamide
CID 79601075

Frequently Asked Questions

What is the IUPAC name of N-[2-[cyclopropyl(methyl)amino]ethyl]-3-hydroxy-4-methoxybenzamide?
The IUPAC name of N-[2-[cyclopropyl(methyl)amino]ethyl]-3-hydroxy-4-methoxybenzamide (CID 79673447) is N-[2-[cyclopropyl(methyl)amino]ethyl]-3-hydroxy-4-methoxybenzamide.
What is the SMILES notation for N-[2-[cyclopropyl(methyl)amino]ethyl]-3-hydroxy-4-methoxybenzamide?
The canonical SMILES for N-[2-[cyclopropyl(methyl)amino]ethyl]-3-hydroxy-4-methoxybenzamide is COc1ccc(C(=O)NCCN(C)C2CC2)cc1O.
What is the InChIKey of N-[2-[cyclopropyl(methyl)amino]ethyl]-3-hydroxy-4-methoxybenzamide?
The InChIKey is SAFYEFKKLDYMIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-16(11-4-5-11)8-7-15-14(18)10-3-6-13(19-2)12(17)9-10/h3,6,9,11,17H,4-5,7-8H2,1-2H3,(H,15,18).
What are the key properties of N-[2-[cyclopropyl(methyl)amino]ethyl]-3-hydroxy-4-methoxybenzamide?
N-[2-[cyclopropyl(methyl)amino]ethyl]-3-hydroxy-4-methoxybenzamide has a molecular weight of 264.32 g/mol, XLogP of 1.22, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[cyclopropyl(methyl)amino]ethyl]-3-hydroxy-4-methoxybenzamide is sourced from PubChem (CID 79673447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).