1-[5-[(5-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]propan-2-amine

C15H16ClFN2O — CID 103049291

IUPAC1-[5-[(5-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]propan-2-amine
SMILESCC(N)Cc1ccc(OCc2cc(Cl)ccc2F)cn1
InChIInChI=1S/C15H16ClFN2O/c1-10(18)6-13-3-4-14(8-19-13)20-9-11-7-12(16)2-5-15(11)17/h2-5,7-8,10H,6,9,18H2,1H3
InChIKeyPUJCYCHNCGQHHN-UHFFFAOYSA-N
MW294.76 g/mol
LogP3.34
Rot. Bonds5

About 1-[5-[(5-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]propan-2-amine

1-[5-[(5-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]propan-2-amine (PubChem CID 103049291) has the molecular formula C15H16ClFN2O and a molecular weight of 294.76 g/mol. Its IUPAC name is 1-[5-[(5-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]propan-2-amine.

Molecular Properties

Compound Name1-[5-[(5-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]propan-2-amine
PubChem CID103049291
Molecular FormulaC15H16ClFN2O
Molecular Weight294.76 g/mol
Exact Mass294.09
IUPAC Name1-[5-[(5-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]propan-2-amine
SMILESCC(N)Cc1ccc(OCc2cc(Cl)ccc2F)cn1
InChIInChI=1S/C15H16ClFN2O/c1-10(18)6-13-3-4-14(8-19-13)20-9-11-7-12(16)2-5-15(11)17/h2-5,7-8,10H,6,9,18H2,1H3
InChIKeyPUJCYCHNCGQHHN-UHFFFAOYSA-N
XLogP3.34
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.76
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[5-[(5-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]propan-2-amine 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-[5-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]propan-2-amine
CID 114857523
N-[[5-[(5-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]methyl]propan-1-amine
CID 103046448
N-[[5-[(5-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]methyl]cyclopropanamine
CID 103046450
1-[5-(2-fluoroethoxy)-2-pyridinyl]propan-2-amine
CID 80694475
N-[[5-[(2,5-dichlorophenyl)methoxy]-2-pyridinyl]methyl]propan-2-amine
CID 79781870
1-[5-(3-chloroprop-2-enoxy)-2-pyridinyl]propan-2-amine
CID 79799523
1-(5-prop-2-enoxy-2-pyridinyl)propan-2-amine
CID 79795581
2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]acetamide
CID 79800080
1-(5-prop-2-ynoxy-2-pyridinyl)propan-2-amine
CID 79799433
1-(5-pentoxy-2-pyridinyl)propan-2-amine
CID 79799904
1-[5-[(3-chlorophenyl)methoxy]-2-pyridinyl]butan-2-amine
CID 79795411
N-[[5-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]methyl]propan-1-amine
CID 114848226

Frequently Asked Questions

What is the IUPAC name of 1-[5-[(5-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]propan-2-amine?
The IUPAC name of 1-[5-[(5-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]propan-2-amine (CID 103049291) is 1-[5-[(5-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]propan-2-amine.
What is the SMILES notation for 1-[5-[(5-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]propan-2-amine?
The canonical SMILES for 1-[5-[(5-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]propan-2-amine is CC(N)Cc1ccc(OCc2cc(Cl)ccc2F)cn1.
What is the InChIKey of 1-[5-[(5-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]propan-2-amine?
The InChIKey is PUJCYCHNCGQHHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClFN2O/c1-10(18)6-13-3-4-14(8-19-13)20-9-11-7-12(16)2-5-15(11)17/h2-5,7-8,10H,6,9,18H2,1H3.
What are the key properties of 1-[5-[(5-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]propan-2-amine?
1-[5-[(5-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]propan-2-amine has a molecular weight of 294.76 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[(5-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]propan-2-amine is sourced from PubChem (CID 103049291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).