N-cyclopentyl-4-(3-methylbutoxy)benzamide

C17H25NO2 — CID 4948351

IUPACN-cyclopentyl-4-(3-methylbutoxy)benzamide
SMILESCC(C)CCOc1ccc(C(=O)NC2CCCC2)cc1
InChIInChI=1S/C17H25NO2/c1-13(2)11-12-20-16-9-7-14(8-10-16)17(19)18-15-5-3-4-6-15/h7-10,13,15H,3-6,11-12H2,1-2H3,(H,18,19)
InChIKeyMDPYEXCSPQURPB-UHFFFAOYSA-N
MW275.39 g/mol
LogP3.78
Rot. Bonds6

About N-cyclopentyl-4-(3-methylbutoxy)benzamide

N-cyclopentyl-4-(3-methylbutoxy)benzamide (PubChem CID 4948351) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is N-cyclopentyl-4-(3-methylbutoxy)benzamide.

Molecular Properties

Compound NameN-cyclopentyl-4-(3-methylbutoxy)benzamide
PubChem CID4948351
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC NameN-cyclopentyl-4-(3-methylbutoxy)benzamide
SMILESCC(C)CCOc1ccc(C(=O)NC2CCCC2)cc1
InChIInChI=1S/C17H25NO2/c1-13(2)11-12-20-16-9-7-14(8-10-16)17(19)18-15-5-3-4-6-15/h7-10,13,15H,3-6,11-12H2,1-2H3,(H,18,19)
InChIKeyMDPYEXCSPQURPB-UHFFFAOYSA-N
XLogP3.78
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-4-propoxybenzamide
CID 4938429
4-(3-methylbutoxy)-N-(2-methylpiperidin-4-yl)benzamide
CID 120598414
4-butoxy-N-cyclobutylbenzamide
CID 71449411
4-(2-aminoethoxy)-N-cyclohexylbenzamide
CID 22362508
4-N-cyclohexyl-1-N-[2-(4-methoxyphenoxy)ethyl]benzene-1,4-dicarboxamide
CID 109044769
4-(3-methylbutoxy)-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride
CID 120553316
4-butoxy-N'-[4-(3-methylbutoxy)benzoyl]benzohydrazide
CID 4936465
N-cyclopentyl-4-[2-[[(1R)-1-cyclopropylethyl]amino]-2-oxoethoxy]benzamide
CID 95310406
N-(3-hydroxypropyl)-4-(3-methylbutoxy)benzamide
CID 78796548
N-cyclohexyl-N-methyl-4-(3-methylbutoxy)benzamide
CID 4948247
N'-[4-(3-methylbutoxy)benzoyl]-4-propan-2-ylbenzohydrazide
CID 17177576
N-butan-2-yl-4-(3-methylbutoxy)benzamide
CID 17137403

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-(3-methylbutoxy)benzamide?
The IUPAC name of N-cyclopentyl-4-(3-methylbutoxy)benzamide (CID 4948351) is N-cyclopentyl-4-(3-methylbutoxy)benzamide.
What is the SMILES notation for N-cyclopentyl-4-(3-methylbutoxy)benzamide?
The canonical SMILES for N-cyclopentyl-4-(3-methylbutoxy)benzamide is CC(C)CCOc1ccc(C(=O)NC2CCCC2)cc1.
What is the InChIKey of N-cyclopentyl-4-(3-methylbutoxy)benzamide?
The InChIKey is MDPYEXCSPQURPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-13(2)11-12-20-16-9-7-14(8-10-16)17(19)18-15-5-3-4-6-15/h7-10,13,15H,3-6,11-12H2,1-2H3,(H,18,19).
What are the key properties of N-cyclopentyl-4-(3-methylbutoxy)benzamide?
N-cyclopentyl-4-(3-methylbutoxy)benzamide has a molecular weight of 275.39 g/mol, XLogP of 3.78, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-(3-methylbutoxy)benzamide is sourced from PubChem (CID 4948351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).