N-[2-(aminomethyl)-2-ethylbutyl]-4-methoxybenzamide

C15H24N2O2 — CID 106250544

IUPACN-[2-(aminomethyl)-2-ethylbutyl]-4-methoxybenzamide
SMILESCCC(CC)(CN)CNC(=O)c1ccc(OC)cc1
InChIInChI=1S/C15H24N2O2/c1-4-15(5-2,10-16)11-17-14(18)12-6-8-13(19-3)9-7-12/h6-9H,4-5,10-11,16H2,1-3H3,(H,17,18)
InChIKeyDYMAKQOTNWRNOH-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.19
Rot. Bonds7

About N-[2-(aminomethyl)-2-ethylbutyl]-4-methoxybenzamide

N-[2-(aminomethyl)-2-ethylbutyl]-4-methoxybenzamide (PubChem CID 106250544) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[2-(aminomethyl)-2-ethylbutyl]-4-methoxybenzamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)-2-ethylbutyl]-4-methoxybenzamide
PubChem CID106250544
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[2-(aminomethyl)-2-ethylbutyl]-4-methoxybenzamide
SMILESCCC(CC)(CN)CNC(=O)c1ccc(OC)cc1
InChIInChI=1S/C15H24N2O2/c1-4-15(5-2,10-16)11-17-14(18)12-6-8-13(19-3)9-7-12/h6-9H,4-5,10-11,16H2,1-3H3,(H,17,18)
InChIKeyDYMAKQOTNWRNOH-UHFFFAOYSA-N
XLogP2.19
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(aminomethyl)-2-ethylbutyl]-3,4-dimethoxybenzamide
CID 106250783
N-[2-(aminomethyl)-2-ethylbutyl]-6-methylpyridine-3-carboxamide
CID 114164010
N-(3-chloro-2,2-dimethylpropyl)-4-methoxybenzamide
CID 115364498
N-(2,2-difluoro-3-hydroxypropyl)-4-methoxybenzamide
CID 104857865
N-[2-(aminomethyl)-2-ethylbutyl]-1,3-dihydro-2-benzofuran-5-carboxamide
CID 106249948
N-[2-(aminomethyl)-2-ethylbutyl]-5-methylfuran-2-carboxamide
CID 106250802
N-[2-(4-methoxyphenyl)-2-methylpropyl]-4-(trifluoromethyl)benzamide
CID 113090468
N-[4-(1-amino-2-methylpropan-2-yl)phenyl]-4-methoxybenzamide
CID 14698593
N-[2-ethyl-2-(hydroxymethyl)butyl]-4-prop-2-enoxybenzamide
CID 103843312
4-methoxy-N-pentylbenzamide
CID 3113360
2-[(4-methoxybenzoyl)amino]acetate
CID 6920131
N-[2-[(4-methoxybenzoyl)amino]ethyl]-4-methylbenzamide
CID 108537787

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)-2-ethylbutyl]-4-methoxybenzamide?
The IUPAC name of N-[2-(aminomethyl)-2-ethylbutyl]-4-methoxybenzamide (CID 106250544) is N-[2-(aminomethyl)-2-ethylbutyl]-4-methoxybenzamide.
What is the SMILES notation for N-[2-(aminomethyl)-2-ethylbutyl]-4-methoxybenzamide?
The canonical SMILES for N-[2-(aminomethyl)-2-ethylbutyl]-4-methoxybenzamide is CCC(CC)(CN)CNC(=O)c1ccc(OC)cc1.
What is the InChIKey of N-[2-(aminomethyl)-2-ethylbutyl]-4-methoxybenzamide?
The InChIKey is DYMAKQOTNWRNOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-4-15(5-2,10-16)11-17-14(18)12-6-8-13(19-3)9-7-12/h6-9H,4-5,10-11,16H2,1-3H3,(H,17,18).
What are the key properties of N-[2-(aminomethyl)-2-ethylbutyl]-4-methoxybenzamide?
N-[2-(aminomethyl)-2-ethylbutyl]-4-methoxybenzamide has a molecular weight of 264.37 g/mol, XLogP of 2.19, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)-2-ethylbutyl]-4-methoxybenzamide is sourced from PubChem (CID 106250544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).