N-(4-hydroxyazepan-3-yl)-4-methoxybenzamide

C14H20N2O3 — CID 74505343

IUPACN-(4-hydroxyazepan-3-yl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2CNCCCC2O)cc1
InChIInChI=1S/C14H20N2O3/c1-19-11-6-4-10(5-7-11)14(18)16-12-9-15-8-2-3-13(12)17/h4-7,12-13,15,17H,2-3,8-9H2,1H3,(H,16,18)
InChIKeyJPNLMUGYFSSICV-UHFFFAOYSA-N
MW264.32 g/mol
LogP0.54
Rot. Bonds3

About N-(4-hydroxyazepan-3-yl)-4-methoxybenzamide

N-(4-hydroxyazepan-3-yl)-4-methoxybenzamide (PubChem CID 74505343) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is N-(4-hydroxyazepan-3-yl)-4-methoxybenzamide.

Molecular Properties

Compound NameN-(4-hydroxyazepan-3-yl)-4-methoxybenzamide
PubChem CID74505343
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC NameN-(4-hydroxyazepan-3-yl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2CNCCCC2O)cc1
InChIInChI=1S/C14H20N2O3/c1-19-11-6-4-10(5-7-11)14(18)16-12-9-15-8-2-3-13(12)17/h4-7,12-13,15,17H,2-3,8-9H2,1H3,(H,16,18)
InChIKeyJPNLMUGYFSSICV-UHFFFAOYSA-N
XLogP0.54
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 50.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3,5-dimethoxyphenyl)-N-[(3R,4R)-3-hydroxypiperidin-4-yl]benzamide
CID 121498106
4-methoxy-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119556793
N-[(1S,3S)-3-hydroxycyclohexyl]-4-methoxybenzamide
CID 95983830
N-[(3S)-2-hydroxyoxolan-3-yl]-4-methoxybenzamide
CID 146504792
N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-4-methoxybenzamide
CID 51665263
(3R,4R)-4-hydroxy-3-[(4-methoxybenzoyl)amino]-N-propan-2-ylazepane-1-carboxamide
CID 26742078
4-methoxy-N-(2-oxoazepan-4-yl)benzamide
CID 19090438
4-(4-methoxyphenyl)-4-oxo-N-piperidin-3-ylbutanamide
CID 119426454
3,5-dimethoxy-N-piperidin-3-ylbenzamide;hydrochloride
CID 119424226
4-(4-methoxyphenyl)-4-oxo-N-piperidin-3-ylbutanamide;hydrochloride
CID 119426453
4-hydroxy-N-[4-hydroxy-1-[(4-methoxyphenyl)methyl]azepan-3-yl]benzamide
CID 74505449
4-methoxy-N-(2-methylpiperidin-4-yl)benzamide
CID 106995490

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyazepan-3-yl)-4-methoxybenzamide?
The IUPAC name of N-(4-hydroxyazepan-3-yl)-4-methoxybenzamide (CID 74505343) is N-(4-hydroxyazepan-3-yl)-4-methoxybenzamide.
What is the SMILES notation for N-(4-hydroxyazepan-3-yl)-4-methoxybenzamide?
The canonical SMILES for N-(4-hydroxyazepan-3-yl)-4-methoxybenzamide is COc1ccc(C(=O)NC2CNCCCC2O)cc1.
What is the InChIKey of N-(4-hydroxyazepan-3-yl)-4-methoxybenzamide?
The InChIKey is JPNLMUGYFSSICV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-19-11-6-4-10(5-7-11)14(18)16-12-9-15-8-2-3-13(12)17/h4-7,12-13,15,17H,2-3,8-9H2,1H3,(H,16,18).
What are the key properties of N-(4-hydroxyazepan-3-yl)-4-methoxybenzamide?
N-(4-hydroxyazepan-3-yl)-4-methoxybenzamide has a molecular weight of 264.32 g/mol, XLogP of 0.54, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyazepan-3-yl)-4-methoxybenzamide is sourced from PubChem (CID 74505343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).