N-[[5-chloro-6-(furan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine

C14H17ClN2O2 — CID 55058571

IUPACN-[[5-chloro-6-(furan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine
SMILESCC(C)NCc1cnc(OCc2ccco2)c(Cl)c1
InChIInChI=1S/C14H17ClN2O2/c1-10(2)16-7-11-6-13(15)14(17-8-11)19-9-12-4-3-5-18-12/h3-6,8,10,16H,7,9H2,1-2H3
InChIKeyUEMBGKMFEFIUQG-UHFFFAOYSA-N
MW280.75 g/mol
LogP3.40
Rot. Bonds6

About N-[[5-chloro-6-(furan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine

N-[[5-chloro-6-(furan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine (PubChem CID 55058571) has the molecular formula C14H17ClN2O2 and a molecular weight of 280.75 g/mol. Its IUPAC name is N-[[5-chloro-6-(furan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[5-chloro-6-(furan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine
PubChem CID55058571
Molecular FormulaC14H17ClN2O2
Molecular Weight280.75 g/mol
Exact Mass280.10
IUPAC NameN-[[5-chloro-6-(furan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine
SMILESCC(C)NCc1cnc(OCc2ccco2)c(Cl)c1
InChIInChI=1S/C14H17ClN2O2/c1-10(2)16-7-11-6-13(15)14(17-8-11)19-9-12-4-3-5-18-12/h3-6,8,10,16H,7,9H2,1-2H3
InChIKeyUEMBGKMFEFIUQG-UHFFFAOYSA-N
XLogP3.40
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.75
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[5-chloro-6-(furan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine with MolForge

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Related Compounds

N-[[5-chloro-6-[(4-chlorophenyl)methoxy]-3-pyridinyl]methyl]propan-2-amine
CID 65125298
N-[[5-chloro-6-(2,2-difluoroethoxy)-3-pyridinyl]methyl]propan-2-amine
CID 82005702
N-[[5-chloro-6-(cyclopropylmethoxy)-3-pyridinyl]methyl]propan-2-amine
CID 62291329
N-[[5-chloro-6-(cyclopentylmethoxy)-3-pyridinyl]methyl]propan-2-amine
CID 66321851
3,5-dichloro-6-(furan-2-ylmethoxy)pyridin-2-amine
CID 102760408
1-[5-fluoro-2-(furan-2-ylmethoxy)-3-pyridinyl]-N-methylmethanamine
CID 114035519
2-chloro-N-ethyl-N-(furan-2-ylmethyl)-4-[(propan-2-ylamino)methyl]aniline
CID 81146652
N-[[5-(furan-2-ylmethoxymethyl)-1,2-oxazol-3-yl]methyl]propan-2-amine
CID 55072772
N-[[6-(5-bromo-2-methylphenoxy)-5-chloro-3-pyridinyl]methyl]propan-2-amine
CID 107285773
N-[[5-chloro-6-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methyl]propan-2-amine
CID 64854100
N-[[5-(furan-2-ylmethoxymethyl)furan-2-yl]methyl]propan-2-amine
CID 62443693
N-[[5-chloro-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]-3-pyridinyl]methyl]propan-2-amine
CID 62291414

Frequently Asked Questions

What is the IUPAC name of N-[[5-chloro-6-(furan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine?
The IUPAC name of N-[[5-chloro-6-(furan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine (CID 55058571) is N-[[5-chloro-6-(furan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine.
What is the SMILES notation for N-[[5-chloro-6-(furan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine?
The canonical SMILES for N-[[5-chloro-6-(furan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine is CC(C)NCc1cnc(OCc2ccco2)c(Cl)c1.
What is the InChIKey of N-[[5-chloro-6-(furan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine?
The InChIKey is UEMBGKMFEFIUQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN2O2/c1-10(2)16-7-11-6-13(15)14(17-8-11)19-9-12-4-3-5-18-12/h3-6,8,10,16H,7,9H2,1-2H3.
What are the key properties of N-[[5-chloro-6-(furan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine?
N-[[5-chloro-6-(furan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine has a molecular weight of 280.75 g/mol, XLogP of 3.40, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-chloro-6-(furan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine is sourced from PubChem (CID 55058571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).