7-(2-aminopropyl)-N,N-dimethyl-1-benzofuran-2-carboxamide;hydrochloride

C14H19ClN2O2 — CID 140503736

IUPAC7-(2-aminopropyl)-N,N-dimethyl-1-benzofuran-2-carboxamide;hydrochloride
SMILESCC(N)Cc1cccc2cc(C(=O)N(C)C)oc12.Cl
InChIInChI=1S/C14H18N2O2.ClH/c1-9(15)7-10-5-4-6-11-8-12(18-13(10)11)14(17)16(2)3;/h4-6,8-9H,7,15H2,1-3H3;1H
InChIKeyGNSOAZCIERXQTR-UHFFFAOYSA-N
MW282.77 g/mol
LogP2.45
Rot. Bonds3

About 7-(2-aminopropyl)-N,N-dimethyl-1-benzofuran-2-carboxamide;hydrochloride

7-(2-aminopropyl)-N,N-dimethyl-1-benzofuran-2-carboxamide;hydrochloride (PubChem CID 140503736) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is 7-(2-aminopropyl)-N,N-dimethyl-1-benzofuran-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name7-(2-aminopropyl)-N,N-dimethyl-1-benzofuran-2-carboxamide;hydrochloride
PubChem CID140503736
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC Name7-(2-aminopropyl)-N,N-dimethyl-1-benzofuran-2-carboxamide;hydrochloride
SMILESCC(N)Cc1cccc2cc(C(=O)N(C)C)oc12.Cl
InChIInChI=1S/C14H18N2O2.ClH/c1-9(15)7-10-5-4-6-11-8-12(18-13(10)11)14(17)16(2)3;/h4-6,8-9H,7,15H2,1-3H3;1H
InChIKeyGNSOAZCIERXQTR-UHFFFAOYSA-N
XLogP2.45
TPSA59.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-(2-aminopropyl)-N,N-dimethyl-1-benzofuran-2-carboxamide;hydrochloride?
The IUPAC name of 7-(2-aminopropyl)-N,N-dimethyl-1-benzofuran-2-carboxamide;hydrochloride (CID 140503736) is 7-(2-aminopropyl)-N,N-dimethyl-1-benzofuran-2-carboxamide;hydrochloride.
What is the SMILES notation for 7-(2-aminopropyl)-N,N-dimethyl-1-benzofuran-2-carboxamide;hydrochloride?
The canonical SMILES for 7-(2-aminopropyl)-N,N-dimethyl-1-benzofuran-2-carboxamide;hydrochloride is CC(N)Cc1cccc2cc(C(=O)N(C)C)oc12.Cl.
What is the InChIKey of 7-(2-aminopropyl)-N,N-dimethyl-1-benzofuran-2-carboxamide;hydrochloride?
The InChIKey is GNSOAZCIERXQTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2.ClH/c1-9(15)7-10-5-4-6-11-8-12(18-13(10)11)14(17)16(2)3;/h4-6,8-9H,7,15H2,1-3H3;1H.
What are the key properties of 7-(2-aminopropyl)-N,N-dimethyl-1-benzofuran-2-carboxamide;hydrochloride?
7-(2-aminopropyl)-N,N-dimethyl-1-benzofuran-2-carboxamide;hydrochloride has a molecular weight of 282.77 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-aminopropyl)-N,N-dimethyl-1-benzofuran-2-carboxamide;hydrochloride is sourced from PubChem (CID 140503736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).