2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylpentanamide;hydrochloride

C17H28ClN3O3 — CID 119267711

IUPAC2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylpentanamide;hydrochloride
SMILESCCCC(N)C(=O)N(CCC)CC(=O)Nc1ccccc1OC.Cl
InChIInChI=1S/C17H27N3O3.ClH/c1-4-8-13(18)17(22)20(11-5-2)12-16(21)19-14-9-6-7-10-15(14)23-3;/h6-7,9-10,13H,4-5,8,11-12,18H2,1-3H3,(H,19,21);1H
InChIKeyWAUZOEPNXMJHPF-UHFFFAOYSA-N
MW357.88 g/mol
LogP2.42
Rot. Bonds9

About 2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylpentanamide;hydrochloride

2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylpentanamide;hydrochloride (PubChem CID 119267711) has the molecular formula C17H28ClN3O3 and a molecular weight of 357.88 g/mol. Its IUPAC name is 2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylpentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylpentanamide;hydrochloride
PubChem CID119267711
Molecular FormulaC17H28ClN3O3
Molecular Weight357.88 g/mol
Exact Mass357.18
IUPAC Name2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylpentanamide;hydrochloride
SMILESCCCC(N)C(=O)N(CCC)CC(=O)Nc1ccccc1OC.Cl
InChIInChI=1S/C17H27N3O3.ClH/c1-4-8-13(18)17(22)20(11-5-2)12-16(21)19-14-9-6-7-10-15(14)23-3;/h6-7,9-10,13H,4-5,8,11-12,18H2,1-3H3,(H,19,21);1H
InChIKeyWAUZOEPNXMJHPF-UHFFFAOYSA-N
XLogP2.42
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.88
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylacetamide
CID 119267704
(2R)-2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide;hydrochloride
CID 119267268
4-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylbutanamide
CID 119267716
3-[acetyl(propyl)amino]-N-(2-methoxyphenyl)propanamide
CID 113115042
2-[(3-amino-4-methylpentyl)-methylamino]-N-(2-methoxyphenyl)acetamide
CID 81496851
2-[(2-benzylsulfanylacetyl)-propylamino]-N-(2-methoxyphenyl)acetamide
CID 8620896
2-(3,6-dihydro-2H-pyridin-1-yl)-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylacetamide
CID 166204006
2-[butyl(methyl)amino]-N-(2-methoxyphenyl)acetamide
CID 109006138
3-(2-bromophenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylprop-2-enamide
CID 76856671
2-bromo-5-fluoro-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylbenzamide
CID 134008468
2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120787699
2-[hexyl(propyl)amino]-N-(2-methoxyphenyl)acetamide
CID 78820994

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylpentanamide;hydrochloride?
The IUPAC name of 2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylpentanamide;hydrochloride (CID 119267711) is 2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylpentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylpentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylpentanamide;hydrochloride is CCCC(N)C(=O)N(CCC)CC(=O)Nc1ccccc1OC.Cl.
What is the InChIKey of 2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylpentanamide;hydrochloride?
The InChIKey is WAUZOEPNXMJHPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O3.ClH/c1-4-8-13(18)17(22)20(11-5-2)12-16(21)19-14-9-6-7-10-15(14)23-3;/h6-7,9-10,13H,4-5,8,11-12,18H2,1-3H3,(H,19,21);1H.
What are the key properties of 2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylpentanamide;hydrochloride?
2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylpentanamide;hydrochloride has a molecular weight of 357.88 g/mol, XLogP of 2.42, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylpentanamide;hydrochloride is sourced from PubChem (CID 119267711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).