N-cyclobutyl-N-(3-hydroxypropyl)-4-methoxybenzamide

C15H21NO3 — CID 102866210

IUPACN-cyclobutyl-N-(3-hydroxypropyl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)N(CCCO)C2CCC2)cc1
InChIInChI=1S/C15H21NO3/c1-19-14-8-6-12(7-9-14)15(18)16(10-3-11-17)13-4-2-5-13/h6-9,13,17H,2-5,10-11H2,1H3
InChIKeyZCCDRWODAMNUJG-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.07
Rot. Bonds6

About N-cyclobutyl-N-(3-hydroxypropyl)-4-methoxybenzamide

N-cyclobutyl-N-(3-hydroxypropyl)-4-methoxybenzamide (PubChem CID 102866210) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-cyclobutyl-N-(3-hydroxypropyl)-4-methoxybenzamide.

Molecular Properties

Compound NameN-cyclobutyl-N-(3-hydroxypropyl)-4-methoxybenzamide
PubChem CID102866210
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC NameN-cyclobutyl-N-(3-hydroxypropyl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)N(CCCO)C2CCC2)cc1
InChIInChI=1S/C15H21NO3/c1-19-14-8-6-12(7-9-14)15(18)16(10-3-11-17)13-4-2-5-13/h6-9,13,17H,2-5,10-11H2,1H3
InChIKeyZCCDRWODAMNUJG-UHFFFAOYSA-N
XLogP2.07
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-aminopropyl)-N-cyclopropyl-4-methoxybenzamide
CID 43136784
N-cyclobutyl-4-(hydroxymethyl)-N-(3-hydroxypropyl)benzamide
CID 102866633
N-cyclobutyl-N-(3-hydroxypropyl)-2,5-dimethoxybenzamide
CID 102866390
2-amino-N-cyclobutyl-N-(3-hydroxypropyl)-5-methoxybenzamide
CID 102858713
4-(bromomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)benzamide
CID 102861173
1-N,4-N-dicyclohexyl-1-N,4-N-bis(2-hydroxyethyl)benzene-1,4-dicarboxamide
CID 3317185
N-cyclobutyl-N-(3-hydroxypropyl)thiophene-3-carboxamide
CID 102866076
N-cyclobutyl-4-ethyl-N-(2-hydroxyethyl)benzamide
CID 102684931
N-(4-aminocyclohexyl)-N-ethyl-4-methoxybenzamide
CID 79115419
3-[cyclobutyl-[2-(4-methoxyphenyl)ethyl]amino]propan-1-ol
CID 102848724
N-cyclobutyl-3-ethyl-N-(3-hydroxypropyl)thiophene-2-carboxamide
CID 102867056
1-cyclopropyl-1-(4-hydroxybutyl)-3-(4-methoxyphenyl)urea
CID 111430067

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-N-(3-hydroxypropyl)-4-methoxybenzamide?
The IUPAC name of N-cyclobutyl-N-(3-hydroxypropyl)-4-methoxybenzamide (CID 102866210) is N-cyclobutyl-N-(3-hydroxypropyl)-4-methoxybenzamide.
What is the SMILES notation for N-cyclobutyl-N-(3-hydroxypropyl)-4-methoxybenzamide?
The canonical SMILES for N-cyclobutyl-N-(3-hydroxypropyl)-4-methoxybenzamide is COc1ccc(C(=O)N(CCCO)C2CCC2)cc1.
What is the InChIKey of N-cyclobutyl-N-(3-hydroxypropyl)-4-methoxybenzamide?
The InChIKey is ZCCDRWODAMNUJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-19-14-8-6-12(7-9-14)15(18)16(10-3-11-17)13-4-2-5-13/h6-9,13,17H,2-5,10-11H2,1H3.
What are the key properties of N-cyclobutyl-N-(3-hydroxypropyl)-4-methoxybenzamide?
N-cyclobutyl-N-(3-hydroxypropyl)-4-methoxybenzamide has a molecular weight of 263.34 g/mol, XLogP of 2.07, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-N-(3-hydroxypropyl)-4-methoxybenzamide is sourced from PubChem (CID 102866210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).