4-hydroxy-2-methyl-N-(3-piperidin-4-yloxypropyl)benzamide

C16H24N2O3 — CID 107672054

IUPAC4-hydroxy-2-methyl-N-(3-piperidin-4-yloxypropyl)benzamide
SMILESCc1cc(O)ccc1C(=O)NCCCOC1CCNCC1
InChIInChI=1S/C16H24N2O3/c1-12-11-13(19)3-4-15(12)16(20)18-7-2-10-21-14-5-8-17-9-6-14/h3-4,11,14,17,19H,2,5-10H2,1H3,(H,18,20)
InChIKeyGVFCXAVPJMWTLV-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.59
Rot. Bonds6

About 4-hydroxy-2-methyl-N-(3-piperidin-4-yloxypropyl)benzamide

4-hydroxy-2-methyl-N-(3-piperidin-4-yloxypropyl)benzamide (PubChem CID 107672054) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 4-hydroxy-2-methyl-N-(3-piperidin-4-yloxypropyl)benzamide.

Molecular Properties

Compound Name4-hydroxy-2-methyl-N-(3-piperidin-4-yloxypropyl)benzamide
PubChem CID107672054
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name4-hydroxy-2-methyl-N-(3-piperidin-4-yloxypropyl)benzamide
SMILESCc1cc(O)ccc1C(=O)NCCCOC1CCNCC1
InChIInChI=1S/C16H24N2O3/c1-12-11-13(19)3-4-15(12)16(20)18-7-2-10-21-14-5-8-17-9-6-14/h3-4,11,14,17,19H,2,5-10H2,1H3,(H,18,20)
InChIKeyGVFCXAVPJMWTLV-UHFFFAOYSA-N
XLogP1.59
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-hydroxy-2-methyl-N-[3-(2-methylpropoxy)propyl]benzamide
CID 103863566
2-hydroxy-4-methyl-N-(2-piperidin-4-yloxyethyl)benzamide
CID 63870104
4-hydroxy-2-methyl-N-piperidin-4-ylbenzamide
CID 107671351
5-methyl-N-(3-piperidin-4-yloxypropyl)furan-2-carboxamide
CID 55252129
2-bromo-N-(3-piperidin-4-yloxypropyl)furan-3-carboxamide
CID 106855106
3-chloro-2-fluoro-N-(3-piperidin-4-yloxypropyl)benzamide
CID 81264988
3-hydroxy-N-(3-piperidin-4-yloxypropyl)pyridine-2-carboxamide
CID 63870452
3-piperidin-4-yloxypropylcarbamic acid
CID 166772010
2-chloro-3-fluoro-N-(3-piperidin-4-yloxypropyl)benzamide
CID 81454510
2-methoxy-N-(3-piperidin-4-yloxypropyl)pyridine-3-carboxamide
CID 63869445
N-(3-aminopropyl)-4-hydroxy-2-methylbenzamide
CID 107670534
N-(4-chlorobutyl)-4-hydroxy-2-methylbenzamide
CID 107673272

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-2-methyl-N-(3-piperidin-4-yloxypropyl)benzamide?
The IUPAC name of 4-hydroxy-2-methyl-N-(3-piperidin-4-yloxypropyl)benzamide (CID 107672054) is 4-hydroxy-2-methyl-N-(3-piperidin-4-yloxypropyl)benzamide.
What is the SMILES notation for 4-hydroxy-2-methyl-N-(3-piperidin-4-yloxypropyl)benzamide?
The canonical SMILES for 4-hydroxy-2-methyl-N-(3-piperidin-4-yloxypropyl)benzamide is Cc1cc(O)ccc1C(=O)NCCCOC1CCNCC1.
What is the InChIKey of 4-hydroxy-2-methyl-N-(3-piperidin-4-yloxypropyl)benzamide?
The InChIKey is GVFCXAVPJMWTLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-12-11-13(19)3-4-15(12)16(20)18-7-2-10-21-14-5-8-17-9-6-14/h3-4,11,14,17,19H,2,5-10H2,1H3,(H,18,20).
What are the key properties of 4-hydroxy-2-methyl-N-(3-piperidin-4-yloxypropyl)benzamide?
4-hydroxy-2-methyl-N-(3-piperidin-4-yloxypropyl)benzamide has a molecular weight of 292.38 g/mol, XLogP of 1.59, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-2-methyl-N-(3-piperidin-4-yloxypropyl)benzamide is sourced from PubChem (CID 107672054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).