4-(dimethylamino)-N-(4-hydroxypentyl)benzamide

C14H22N2O2 — CID 107329726

IUPAC4-(dimethylamino)-N-(4-hydroxypentyl)benzamide
SMILESCC(O)CCCNC(=O)c1ccc(N(C)C)cc1
InChIInChI=1S/C14H22N2O2/c1-11(17)5-4-10-15-14(18)12-6-8-13(9-7-12)16(2)3/h6-9,11,17H,4-5,10H2,1-3H3,(H,15,18)
InChIKeyCIKVQZCSGQEFDH-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.64
Rot. Bonds6

About 4-(dimethylamino)-N-(4-hydroxypentyl)benzamide

4-(dimethylamino)-N-(4-hydroxypentyl)benzamide (PubChem CID 107329726) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 4-(dimethylamino)-N-(4-hydroxypentyl)benzamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-(4-hydroxypentyl)benzamide
PubChem CID107329726
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name4-(dimethylamino)-N-(4-hydroxypentyl)benzamide
SMILESCC(O)CCCNC(=O)c1ccc(N(C)C)cc1
InChIInChI=1S/C14H22N2O2/c1-11(17)5-4-10-15-14(18)12-6-8-13(9-7-12)16(2)3/h6-9,11,17H,4-5,10H2,1-3H3,(H,15,18)
InChIKeyCIKVQZCSGQEFDH-UHFFFAOYSA-N
XLogP1.64
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-[[4-(dimethylamino)benzoyl]amino]-2-methylpentanoic acid
CID 104682533
4-hydroxy-N-(4-hydroxypentyl)benzamide
CID 107300182
4-(dimethylamino)-N-[3-(dimethylamino)propyl]benzamide
CID 3978888
4-(dimethylamino)-N-pentylbenzamide
CID 21064504
4-(dimethylamino)-N-[6-(hydroxyamino)-5-methyl-6-oxohexyl]benzamide
CID 87895135
4-[[4-(dimethylamino)benzoyl]amino]butanoic acid
CID 10658325
4-(dimethylamino)-N-heptylbenzamide
CID 86046283
4-(carbamoylamino)-N-(4-hydroxypentyl)benzamide
CID 107300353
4-ethoxy-N-(4-hydroxypentyl)benzamide
CID 107299822
N-(2-benzamidoethyl)-4-(dimethylamino)benzamide
CID 38175898
4-(dimethylamino)-N-(3-phenylpropyl)benzamide
CID 27647106
4-tert-butyl-N-[2-[[4-(dimethylamino)benzoyl]amino]ethyl]benzamide
CID 108542009

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-(4-hydroxypentyl)benzamide?
The IUPAC name of 4-(dimethylamino)-N-(4-hydroxypentyl)benzamide (CID 107329726) is 4-(dimethylamino)-N-(4-hydroxypentyl)benzamide.
What is the SMILES notation for 4-(dimethylamino)-N-(4-hydroxypentyl)benzamide?
The canonical SMILES for 4-(dimethylamino)-N-(4-hydroxypentyl)benzamide is CC(O)CCCNC(=O)c1ccc(N(C)C)cc1.
What is the InChIKey of 4-(dimethylamino)-N-(4-hydroxypentyl)benzamide?
The InChIKey is CIKVQZCSGQEFDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-11(17)5-4-10-15-14(18)12-6-8-13(9-7-12)16(2)3/h6-9,11,17H,4-5,10H2,1-3H3,(H,15,18).
What are the key properties of 4-(dimethylamino)-N-(4-hydroxypentyl)benzamide?
4-(dimethylamino)-N-(4-hydroxypentyl)benzamide has a molecular weight of 250.34 g/mol, XLogP of 1.64, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-(4-hydroxypentyl)benzamide is sourced from PubChem (CID 107329726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).