N-[[5-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]-2-methylpropan-2-amine

C15H19ClN2O2 — CID 64601412

IUPACN-[[5-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1coc(COc2cncc(Cl)c2)c1
InChIInChI=1S/C15H19ClN2O2/c1-15(2,3)18-6-11-4-14(19-9-11)10-20-13-5-12(16)7-17-8-13/h4-5,7-9,18H,6,10H2,1-3H3
InChIKeyTUWKYXLRHKMZTM-UHFFFAOYSA-N
MW294.78 g/mol
LogP3.80
Rot. Bonds5

About N-[[5-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]-2-methylpropan-2-amine

N-[[5-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]-2-methylpropan-2-amine (PubChem CID 64601412) has the molecular formula C15H19ClN2O2 and a molecular weight of 294.78 g/mol. Its IUPAC name is N-[[5-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[5-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]-2-methylpropan-2-amine
PubChem CID64601412
Molecular FormulaC15H19ClN2O2
Molecular Weight294.78 g/mol
Exact Mass294.11
IUPAC NameN-[[5-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1coc(COc2cncc(Cl)c2)c1
InChIInChI=1S/C15H19ClN2O2/c1-15(2,3)18-6-11-4-14(19-9-11)10-20-13-5-12(16)7-17-8-13/h4-5,7-9,18H,6,10H2,1-3H3
InChIKeyTUWKYXLRHKMZTM-UHFFFAOYSA-N
XLogP3.80
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.78
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[5-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]-2-methylpropan-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

N-[[5-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]ethanamine
CID 64601411
N-[[5-[(2,5-dichlorophenoxy)methyl]furan-3-yl]methyl]-2-methylpropan-2-amine
CID 62452933
N-[[5-(cyclopentyloxymethyl)furan-3-yl]methyl]-2-methylpropan-2-amine
CID 62444439
N-[[5-[(4-chloropyrazol-1-yl)methyl]furan-3-yl]methyl]-2-methylpropan-2-amine
CID 55073517
N-[[5-[2-(dimethylamino)ethoxymethyl]furan-3-yl]methyl]-2-methylpropan-2-amine
CID 55076989
2-methyl-N-[[5-(1,1,1-trifluoropropan-2-yloxymethyl)furan-3-yl]methyl]propan-2-amine
CID 66275969
N-[[5-[(2-bromo-4-methylphenoxy)methyl]furan-3-yl]methyl]-2-methylpropan-2-amine
CID 62460696
N-[[5-[(4-bromo-2-fluorophenoxy)methyl]furan-3-yl]methyl]-2-methylpropan-2-amine
CID 62485139
N-[[5-chloro-2-[(5-chloro-3-pyridinyl)oxy]phenyl]methyl]-2-methylpropan-2-amine
CID 114857454
N-[[4-[(5-chloro-3-pyridinyl)oxy]-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 64602361
3-[(5-bromofuran-2-yl)methoxy]-5-chloropyridine
CID 130643811
3-chloro-5-[(4-methoxyphenyl)methoxy]pyridine
CID 22607567

Frequently Asked Questions

What is the IUPAC name of N-[[5-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[5-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]-2-methylpropan-2-amine (CID 64601412) is N-[[5-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[5-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[5-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]-2-methylpropan-2-amine is CC(C)(C)NCc1coc(COc2cncc(Cl)c2)c1.
What is the InChIKey of N-[[5-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is TUWKYXLRHKMZTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2O2/c1-15(2,3)18-6-11-4-14(19-9-11)10-20-13-5-12(16)7-17-8-13/h4-5,7-9,18H,6,10H2,1-3H3.
What are the key properties of N-[[5-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]-2-methylpropan-2-amine?
N-[[5-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 294.78 g/mol, XLogP of 3.80, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 64601412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).