1-amino-N-methyl-N-[2-(2-methylphenoxy)ethyl]cyclopropane-1-carboxamide;hydrochloride

C14H21ClN2O2 — CID 119695596

IUPAC1-amino-N-methyl-N-[2-(2-methylphenoxy)ethyl]cyclopropane-1-carboxamide;hydrochloride
SMILESCc1ccccc1OCCN(C)C(=O)C1(N)CC1.Cl
InChIInChI=1S/C14H20N2O2.ClH/c1-11-5-3-4-6-12(11)18-10-9-16(2)13(17)14(15)7-8-14;/h3-6H,7-10,15H2,1-2H3;1H
InChIKeyAGYKRLLNRLYNSN-UHFFFAOYSA-N
MW284.79 g/mol
LogP1.75
Rot. Bonds5

About 1-amino-N-methyl-N-[2-(2-methylphenoxy)ethyl]cyclopropane-1-carboxamide;hydrochloride

1-amino-N-methyl-N-[2-(2-methylphenoxy)ethyl]cyclopropane-1-carboxamide;hydrochloride (PubChem CID 119695596) has the molecular formula C14H21ClN2O2 and a molecular weight of 284.79 g/mol. Its IUPAC name is 1-amino-N-methyl-N-[2-(2-methylphenoxy)ethyl]cyclopropane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-methyl-N-[2-(2-methylphenoxy)ethyl]cyclopropane-1-carboxamide;hydrochloride
PubChem CID119695596
Molecular FormulaC14H21ClN2O2
Molecular Weight284.79 g/mol
Exact Mass284.13
IUPAC Name1-amino-N-methyl-N-[2-(2-methylphenoxy)ethyl]cyclopropane-1-carboxamide;hydrochloride
SMILESCc1ccccc1OCCN(C)C(=O)C1(N)CC1.Cl
InChIInChI=1S/C14H20N2O2.ClH/c1-11-5-3-4-6-12(11)18-10-9-16(2)13(17)14(15)7-8-14;/h3-6H,7-10,15H2,1-2H3;1H
InChIKeyAGYKRLLNRLYNSN-UHFFFAOYSA-N
XLogP1.75
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.79
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-methyl-N-[2-(2-methylphenoxy)ethyl]cyclopropane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-methyl-N-[2-(2-methylphenoxy)ethyl]cyclopropane-1-carboxamide;hydrochloride (CID 119695596) is 1-amino-N-methyl-N-[2-(2-methylphenoxy)ethyl]cyclopropane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-methyl-N-[2-(2-methylphenoxy)ethyl]cyclopropane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-methyl-N-[2-(2-methylphenoxy)ethyl]cyclopropane-1-carboxamide;hydrochloride is Cc1ccccc1OCCN(C)C(=O)C1(N)CC1.Cl.
What is the InChIKey of 1-amino-N-methyl-N-[2-(2-methylphenoxy)ethyl]cyclopropane-1-carboxamide;hydrochloride?
The InChIKey is AGYKRLLNRLYNSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2.ClH/c1-11-5-3-4-6-12(11)18-10-9-16(2)13(17)14(15)7-8-14;/h3-6H,7-10,15H2,1-2H3;1H.
What are the key properties of 1-amino-N-methyl-N-[2-(2-methylphenoxy)ethyl]cyclopropane-1-carboxamide;hydrochloride?
1-amino-N-methyl-N-[2-(2-methylphenoxy)ethyl]cyclopropane-1-carboxamide;hydrochloride has a molecular weight of 284.79 g/mol, XLogP of 1.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-methyl-N-[2-(2-methylphenoxy)ethyl]cyclopropane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119695596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).