1-amino-N-[2-(3-fluorophenyl)ethyl]-N-propylcyclopropane-1-carboxamide;hydrochloride

C15H22ClFN2O — CID 119786800

IUPAC1-amino-N-[2-(3-fluorophenyl)ethyl]-N-propylcyclopropane-1-carboxamide;hydrochloride
SMILESCCCN(CCc1cccc(F)c1)C(=O)C1(N)CC1.Cl
InChIInChI=1S/C15H21FN2O.ClH/c1-2-9-18(14(19)15(17)7-8-15)10-6-12-4-3-5-13(16)11-12;/h3-5,11H,2,6-10,17H2,1H3;1H
InChIKeyXVWITXHBXTYZSH-UHFFFAOYSA-N
MW300.80 g/mol
LogP2.52
Rot. Bonds6

About 1-amino-N-[2-(3-fluorophenyl)ethyl]-N-propylcyclopropane-1-carboxamide;hydrochloride

1-amino-N-[2-(3-fluorophenyl)ethyl]-N-propylcyclopropane-1-carboxamide;hydrochloride (PubChem CID 119786800) has the molecular formula C15H22ClFN2O and a molecular weight of 300.80 g/mol. Its IUPAC name is 1-amino-N-[2-(3-fluorophenyl)ethyl]-N-propylcyclopropane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-[2-(3-fluorophenyl)ethyl]-N-propylcyclopropane-1-carboxamide;hydrochloride
PubChem CID119786800
Molecular FormulaC15H22ClFN2O
Molecular Weight300.80 g/mol
Exact Mass300.14
IUPAC Name1-amino-N-[2-(3-fluorophenyl)ethyl]-N-propylcyclopropane-1-carboxamide;hydrochloride
SMILESCCCN(CCc1cccc(F)c1)C(=O)C1(N)CC1.Cl
InChIInChI=1S/C15H21FN2O.ClH/c1-2-9-18(14(19)15(17)7-8-15)10-6-12-4-3-5-13(16)11-12;/h3-5,11H,2,6-10,17H2,1H3;1H
InChIKeyXVWITXHBXTYZSH-UHFFFAOYSA-N
XLogP2.52
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.80
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-amino-N-[2-(3-fluorophenyl)ethyl]-N-propylcyclopropane-1-carboxamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-amino-N-[2-(3-fluorophenyl)ethyl]-N-propylcyclopentane-1-carboxamide;hydrochloride
CID 119325475
2-amino-N-[2-(3-fluorophenyl)ethyl]-2-methyl-N-propylpentanamide;hydrochloride
CID 119786850
3-amino-N-[2-(3-fluorophenyl)ethyl]-2-methyl-N-propylbutanamide;hydrochloride
CID 120500930
4-(aminomethyl)-N-[2-(3-fluorophenyl)ethyl]-N-propylbenzamide
CID 119325474
1-amino-N-[(3-fluorophenyl)methyl]-N-methylcyclopropane-1-carboxamide
CID 65466557
(E)-4-(dimethylamino)-N-[2-(3-fluorophenyl)ethyl]-N-propylbut-2-enamide
CID 146101000
(2S,5R)-5-(aminomethyl)-N-[2-(3-fluorophenyl)ethyl]-N-propyloxolane-2-carboxamide
CID 120793404
N-[2-(3-fluorophenyl)ethyl]-N-propylhydroxylamine
CID 91048549
1-amino-N-(2-hydroxyethyl)-N-propylcyclopropane-1-carboxamide
CID 65466619
1-[2-(3-fluorophenyl)ethyl]-1-methylurea
CID 115168709
1-amino-N,N-dipropylcyclobutane-1-carboxamide
CID 81167159
1-amino-N-[2-(3-bromophenyl)ethyl]-N-methylcyclopropane-1-carboxamide
CID 115190038

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[2-(3-fluorophenyl)ethyl]-N-propylcyclopropane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-[2-(3-fluorophenyl)ethyl]-N-propylcyclopropane-1-carboxamide;hydrochloride (CID 119786800) is 1-amino-N-[2-(3-fluorophenyl)ethyl]-N-propylcyclopropane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-[2-(3-fluorophenyl)ethyl]-N-propylcyclopropane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-[2-(3-fluorophenyl)ethyl]-N-propylcyclopropane-1-carboxamide;hydrochloride is CCCN(CCc1cccc(F)c1)C(=O)C1(N)CC1.Cl.
What is the InChIKey of 1-amino-N-[2-(3-fluorophenyl)ethyl]-N-propylcyclopropane-1-carboxamide;hydrochloride?
The InChIKey is XVWITXHBXTYZSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O.ClH/c1-2-9-18(14(19)15(17)7-8-15)10-6-12-4-3-5-13(16)11-12;/h3-5,11H,2,6-10,17H2,1H3;1H.
What are the key properties of 1-amino-N-[2-(3-fluorophenyl)ethyl]-N-propylcyclopropane-1-carboxamide;hydrochloride?
1-amino-N-[2-(3-fluorophenyl)ethyl]-N-propylcyclopropane-1-carboxamide;hydrochloride has a molecular weight of 300.80 g/mol, XLogP of 2.52, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[2-(3-fluorophenyl)ethyl]-N-propylcyclopropane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119786800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).