N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2,4-dichlorophenoxy)propanamide;hydrochloride

C15H21Cl3N2O2 — CID 119574900

IUPACN-(1-amino-2-cyclopropylpropan-2-yl)-3-(2,4-dichlorophenoxy)propanamide;hydrochloride
SMILESCC(CN)(NC(=O)CCOc1ccc(Cl)cc1Cl)C1CC1.Cl
InChIInChI=1S/C15H20Cl2N2O2.ClH/c1-15(9-18,10-2-3-10)19-14(20)6-7-21-13-5-4-11(16)8-12(13)17;/h4-5,8,10H,2-3,6-7,9,18H2,1H3,(H,19,20);1H
InChIKeySTRNXZZCEUIIMY-UHFFFAOYSA-N
MW367.70 g/mol
LogP3.43
Rot. Bonds7

About N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2,4-dichlorophenoxy)propanamide;hydrochloride

N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2,4-dichlorophenoxy)propanamide;hydrochloride (PubChem CID 119574900) has the molecular formula C15H21Cl3N2O2 and a molecular weight of 367.70 g/mol. Its IUPAC name is N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2,4-dichlorophenoxy)propanamide;hydrochloride.

Molecular Properties

Compound NameN-(1-amino-2-cyclopropylpropan-2-yl)-3-(2,4-dichlorophenoxy)propanamide;hydrochloride
PubChem CID119574900
Molecular FormulaC15H21Cl3N2O2
Molecular Weight367.70 g/mol
Exact Mass366.07
IUPAC NameN-(1-amino-2-cyclopropylpropan-2-yl)-3-(2,4-dichlorophenoxy)propanamide;hydrochloride
SMILESCC(CN)(NC(=O)CCOc1ccc(Cl)cc1Cl)C1CC1.Cl
InChIInChI=1S/C15H20Cl2N2O2.ClH/c1-15(9-18,10-2-3-10)19-14(20)6-7-21-13-5-4-11(16)8-12(13)17;/h4-5,8,10H,2-3,6-7,9,18H2,1H3,(H,19,20);1H
InChIKeySTRNXZZCEUIIMY-UHFFFAOYSA-N
XLogP3.43
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.70
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2,4-dichlorophenoxy)propanamide;hydrochloride?
The IUPAC name of N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2,4-dichlorophenoxy)propanamide;hydrochloride (CID 119574900) is N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2,4-dichlorophenoxy)propanamide;hydrochloride.
What is the SMILES notation for N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2,4-dichlorophenoxy)propanamide;hydrochloride?
The canonical SMILES for N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2,4-dichlorophenoxy)propanamide;hydrochloride is CC(CN)(NC(=O)CCOc1ccc(Cl)cc1Cl)C1CC1.Cl.
What is the InChIKey of N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2,4-dichlorophenoxy)propanamide;hydrochloride?
The InChIKey is STRNXZZCEUIIMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20Cl2N2O2.ClH/c1-15(9-18,10-2-3-10)19-14(20)6-7-21-13-5-4-11(16)8-12(13)17;/h4-5,8,10H,2-3,6-7,9,18H2,1H3,(H,19,20);1H.
What are the key properties of N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2,4-dichlorophenoxy)propanamide;hydrochloride?
N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2,4-dichlorophenoxy)propanamide;hydrochloride has a molecular weight of 367.70 g/mol, XLogP of 3.43, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2,4-dichlorophenoxy)propanamide;hydrochloride is sourced from PubChem (CID 119574900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).