2-chloro-N-(furan-2-ylmethyl)pyridin-3-amine

C10H9ClN2O — CID 43689872

IUPAC2-chloro-N-(furan-2-ylmethyl)pyridin-3-amine
SMILESClc1ncccc1NCc1ccco1
InChIInChI=1S/C10H9ClN2O/c11-10-9(4-1-5-12-10)13-7-8-3-2-6-14-8/h1-6,13H,7H2
InChIKeyJUICMMGAEVEJAD-UHFFFAOYSA-N
MW208.65 g/mol
LogP2.94
Rot. Bonds3

About 2-chloro-N-(furan-2-ylmethyl)pyridin-3-amine

2-chloro-N-(furan-2-ylmethyl)pyridin-3-amine (PubChem CID 43689872) has the molecular formula C10H9ClN2O and a molecular weight of 208.65 g/mol. Its IUPAC name is 2-chloro-N-(furan-2-ylmethyl)pyridin-3-amine.

Molecular Properties

Compound Name2-chloro-N-(furan-2-ylmethyl)pyridin-3-amine
PubChem CID43689872
Molecular FormulaC10H9ClN2O
Molecular Weight208.65 g/mol
Exact Mass208.04
IUPAC Name2-chloro-N-(furan-2-ylmethyl)pyridin-3-amine
SMILESClc1ncccc1NCc1ccco1
InChIInChI=1S/C10H9ClN2O/c11-10-9(4-1-5-12-10)13-7-8-3-2-6-14-8/h1-6,13H,7H2
InChIKeyJUICMMGAEVEJAD-UHFFFAOYSA-N
XLogP2.94
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.65
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-(furan-2-ylmethyl)pyrimidin-2-amine
CID 28514232
N-(furan-2-ylmethyl)-2-pyrrolidin-1-ylpyridin-3-amine
CID 43676420
2-chloro-N-(furan-3-ylmethyl)pyridin-3-amine
CID 63204400
2-chloro-N-[(4,5-dibromofuran-2-yl)methyl]pyridin-3-amine
CID 62086085
3-fluoro-N-(furan-2-ylmethyl)pyridin-2-amine
CID 62733784
2,5-dichloro-N-(furan-2-ylmethyl)aniline
CID 18778634
N-(furan-2-ylmethyl)-3-methoxy-1-methylpyrazol-4-amine;hydrochloride
CID 126966130
2-chloro-6-(furan-2-ylmethylamino)benzonitrile
CID 60678752
2-chloro-N-(furan-2-ylmethyl)-8-methoxy-1,7-naphthyridin-4-amine
CID 174270619
[(2-chloro-3-pyridinyl)amino]methanol;ethane
CID 158340560
N-(furan-2-ylmethyl)-2-methylsulfanylaniline
CID 43683353
3-[[(2-chloro-3-pyridinyl)amino]methyl]benzene-1,2-diol
CID 61319295

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(furan-2-ylmethyl)pyridin-3-amine?
The IUPAC name of 2-chloro-N-(furan-2-ylmethyl)pyridin-3-amine (CID 43689872) is 2-chloro-N-(furan-2-ylmethyl)pyridin-3-amine.
What is the SMILES notation for 2-chloro-N-(furan-2-ylmethyl)pyridin-3-amine?
The canonical SMILES for 2-chloro-N-(furan-2-ylmethyl)pyridin-3-amine is Clc1ncccc1NCc1ccco1.
What is the InChIKey of 2-chloro-N-(furan-2-ylmethyl)pyridin-3-amine?
The InChIKey is JUICMMGAEVEJAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2O/c11-10-9(4-1-5-12-10)13-7-8-3-2-6-14-8/h1-6,13H,7H2.
What are the key properties of 2-chloro-N-(furan-2-ylmethyl)pyridin-3-amine?
2-chloro-N-(furan-2-ylmethyl)pyridin-3-amine has a molecular weight of 208.65 g/mol, XLogP of 2.94, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(furan-2-ylmethyl)pyridin-3-amine is sourced from PubChem (CID 43689872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).