N-(3-hydroxyphenyl)-N-methylpentanamide

C12H17NO2 — CID 107735913

IUPACN-(3-hydroxyphenyl)-N-methylpentanamide
SMILESCCCCC(=O)N(C)c1cccc(O)c1
InChIInChI=1S/C12H17NO2/c1-3-4-8-12(15)13(2)10-6-5-7-11(14)9-10/h5-7,9,14H,3-4,8H2,1-2H3
InChIKeyWAGDMAHXWOLGRN-UHFFFAOYSA-N
MW207.27 g/mol
LogP2.55
Rot. Bonds4

About N-(3-hydroxyphenyl)-N-methylpentanamide

N-(3-hydroxyphenyl)-N-methylpentanamide (PubChem CID 107735913) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is N-(3-hydroxyphenyl)-N-methylpentanamide.

Molecular Properties

Compound NameN-(3-hydroxyphenyl)-N-methylpentanamide
PubChem CID107735913
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC NameN-(3-hydroxyphenyl)-N-methylpentanamide
SMILESCCCCC(=O)N(C)c1cccc(O)c1
InChIInChI=1S/C12H17NO2/c1-3-4-8-12(15)13(2)10-6-5-7-11(14)9-10/h5-7,9,14H,3-4,8H2,1-2H3
InChIKeyWAGDMAHXWOLGRN-UHFFFAOYSA-N
XLogP2.55
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-hydroxyphenyl)-N-methylnonanamide
CID 107736082
ethyl 4-(3-hydroxy-N-methylanilino)-4-oxobutanoate
CID 107734000
3-amino-N-(3-hydroxyphenyl)-N-methylpentanamide
CID 107734648
N-(3-hydroxyphenyl)-N,4-dimethylpentanamide
CID 107735895
N-ethyl-N-(3-hydroxyphenyl)heptanamide
CID 107736474
N-[3-(aminomethyl)phenyl]-N-methyldecanamide
CID 65447779
2-ethyl-N-(3-hydroxyphenyl)-N-methylhexanamide
CID 107735712
N-methyl-N-phenylnonanamide
CID 54136731
(3-hydroxyphenyl)-methylcarbamic acid
CID 20544632
1-(3-hydroxyphenyl)-1-methyl-3-propylurea
CID 107734166
2,2-diethyl-4-(3-hydroxy-N-methylanilino)-4-oxobutanoic acid
CID 107734007
N-(3-hydroxyphenyl)-3-(4-methoxyphenyl)-N-methylpropanamide
CID 107735768

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxyphenyl)-N-methylpentanamide?
The IUPAC name of N-(3-hydroxyphenyl)-N-methylpentanamide (CID 107735913) is N-(3-hydroxyphenyl)-N-methylpentanamide.
What is the SMILES notation for N-(3-hydroxyphenyl)-N-methylpentanamide?
The canonical SMILES for N-(3-hydroxyphenyl)-N-methylpentanamide is CCCCC(=O)N(C)c1cccc(O)c1.
What is the InChIKey of N-(3-hydroxyphenyl)-N-methylpentanamide?
The InChIKey is WAGDMAHXWOLGRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-3-4-8-12(15)13(2)10-6-5-7-11(14)9-10/h5-7,9,14H,3-4,8H2,1-2H3.
What are the key properties of N-(3-hydroxyphenyl)-N-methylpentanamide?
N-(3-hydroxyphenyl)-N-methylpentanamide has a molecular weight of 207.27 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxyphenyl)-N-methylpentanamide is sourced from PubChem (CID 107735913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).