N-(2-aminopentyl)-2-methoxy-5-methylbenzamide

C14H22N2O2 — CID 115737842

IUPACN-(2-aminopentyl)-2-methoxy-5-methylbenzamide
SMILESCCCC(N)CNC(=O)c1cc(C)ccc1OC
InChIInChI=1S/C14H22N2O2/c1-4-5-11(15)9-16-14(17)12-8-10(2)6-7-13(12)18-3/h6-8,11H,4-5,9,15H2,1-3H3,(H,16,17)
InChIKeyGUIKQYBDRAWBEB-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.86
Rot. Bonds6

About N-(2-aminopentyl)-2-methoxy-5-methylbenzamide

N-(2-aminopentyl)-2-methoxy-5-methylbenzamide (PubChem CID 115737842) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is N-(2-aminopentyl)-2-methoxy-5-methylbenzamide.

Molecular Properties

Compound NameN-(2-aminopentyl)-2-methoxy-5-methylbenzamide
PubChem CID115737842
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC NameN-(2-aminopentyl)-2-methoxy-5-methylbenzamide
SMILESCCCC(N)CNC(=O)c1cc(C)ccc1OC
InChIInChI=1S/C14H22N2O2/c1-4-5-11(15)9-16-14(17)12-8-10(2)6-7-13(12)18-3/h6-8,11H,4-5,9,15H2,1-3H3,(H,16,17)
InChIKeyGUIKQYBDRAWBEB-UHFFFAOYSA-N
XLogP1.86
TPSA64.35 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 ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-iodo-3-[(2-methoxy-5-methylbenzoyl)amino]propanoate
CID 103493302
2-hydroxy-3-[(2-methoxy-5-methylbenzoyl)amino]propanoic acid
CID 66166052
3-[[(2-methoxy-5-methylbenzoyl)amino]methyl]pentanoic acid
CID 81065883
N-(2-aminopentyl)-2,4-difluorobenzamide
CID 115737778
N-(2-amino-4-methylpentyl)-2,5-dimethoxybenzamide
CID 107158831
5-amino-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide
CID 106113235
2-methoxy-5-methyl-N-(3-methyl-2-oxobutyl)benzamide
CID 64994334
N-(1-hydroxypentan-3-yl)-2-methoxy-5-methylbenzamide
CID 115767323
N-[2-ethyl-2-(hydroxymethyl)butyl]-2-methoxy-5-methylbenzamide
CID 103843624
N-(2-aminopropyl)-2,5-dimethoxybenzamide
CID 63731879
2-methoxy-5-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
CID 9301929
N-(2-hydroxy-2-methylpentyl)-2-methoxy-5-methylbenzamide
CID 103712986

Frequently Asked Questions

What is the IUPAC name of N-(2-aminopentyl)-2-methoxy-5-methylbenzamide?
The IUPAC name of N-(2-aminopentyl)-2-methoxy-5-methylbenzamide (CID 115737842) is N-(2-aminopentyl)-2-methoxy-5-methylbenzamide.
What is the SMILES notation for N-(2-aminopentyl)-2-methoxy-5-methylbenzamide?
The canonical SMILES for N-(2-aminopentyl)-2-methoxy-5-methylbenzamide is CCCC(N)CNC(=O)c1cc(C)ccc1OC.
What is the InChIKey of N-(2-aminopentyl)-2-methoxy-5-methylbenzamide?
The InChIKey is GUIKQYBDRAWBEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-4-5-11(15)9-16-14(17)12-8-10(2)6-7-13(12)18-3/h6-8,11H,4-5,9,15H2,1-3H3,(H,16,17).
What are the key properties of N-(2-aminopentyl)-2-methoxy-5-methylbenzamide?
N-(2-aminopentyl)-2-methoxy-5-methylbenzamide has a molecular weight of 250.34 g/mol, XLogP of 1.86, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminopentyl)-2-methoxy-5-methylbenzamide is sourced from PubChem (CID 115737842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).