3-fluoro-N-[(5-methylfuran-2-yl)methyl]pyridin-2-amine

C11H11FN2O — CID 62734741

IUPAC3-fluoro-N-[(5-methylfuran-2-yl)methyl]pyridin-2-amine
SMILESCc1ccc(CNc2ncccc2F)o1
InChIInChI=1S/C11H11FN2O/c1-8-4-5-9(15-8)7-14-11-10(12)3-2-6-13-11/h2-6H,7H2,1H3,(H,13,14)
InChIKeyNKUPJLOFZCLTPW-UHFFFAOYSA-N
MW206.22 g/mol
LogP2.73
Rot. Bonds3

About 3-fluoro-N-[(5-methylfuran-2-yl)methyl]pyridin-2-amine

3-fluoro-N-[(5-methylfuran-2-yl)methyl]pyridin-2-amine (PubChem CID 62734741) has the molecular formula C11H11FN2O and a molecular weight of 206.22 g/mol. Its IUPAC name is 3-fluoro-N-[(5-methylfuran-2-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name3-fluoro-N-[(5-methylfuran-2-yl)methyl]pyridin-2-amine
PubChem CID62734741
Molecular FormulaC11H11FN2O
Molecular Weight206.22 g/mol
Exact Mass206.09
IUPAC Name3-fluoro-N-[(5-methylfuran-2-yl)methyl]pyridin-2-amine
SMILESCc1ccc(CNc2ncccc2F)o1
InChIInChI=1S/C11H11FN2O/c1-8-4-5-9(15-8)7-14-11-10(12)3-2-6-13-11/h2-6H,7H2,1H3,(H,13,14)
InChIKeyNKUPJLOFZCLTPW-UHFFFAOYSA-N
XLogP2.73
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(5-methylfuran-2-yl)methylamino]pyridine-3-carbonitrile
CID 62523720
3-fluoro-N-(furan-2-ylmethyl)pyridin-2-amine
CID 62733784
5-fluoro-2-N-methyl-4-N-[(5-methylfuran-2-yl)methyl]pyrimidine-2,4-diamine
CID 80832556
methyl 5-[[(3-fluoro-2-pyridinyl)amino]methyl]-2-methylfuran-3-carboxylate
CID 75483063
N-[(4,5-dimethylthiophen-2-yl)methyl]-3-fluoropyridin-2-amine
CID 65243439
3-fluoro-N-[(2-methylpyrazol-3-yl)methyl]pyridin-2-amine
CID 63302427
3-fluoro-N-[(4-methoxyphenyl)methyl]pyridin-2-amine
CID 62735098
1-methyl-3-[(5-methylfuran-2-yl)methylamino]pyrazin-2-one
CID 62940791
3-fluoro-N-(pyridin-2-ylmethyl)pyridin-2-amine
CID 62733415
6-N,5-dimethyl-4-N-[(5-methylfuran-2-yl)methyl]pyrimidine-4,6-diamine
CID 80832158
N-[(5-methylfuran-2-yl)methyl]-2-propan-2-yloxypyridin-3-amine
CID 61375572
N-[(5-methylfuran-2-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine
CID 43676423

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[(5-methylfuran-2-yl)methyl]pyridin-2-amine?
The IUPAC name of 3-fluoro-N-[(5-methylfuran-2-yl)methyl]pyridin-2-amine (CID 62734741) is 3-fluoro-N-[(5-methylfuran-2-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 3-fluoro-N-[(5-methylfuran-2-yl)methyl]pyridin-2-amine?
The canonical SMILES for 3-fluoro-N-[(5-methylfuran-2-yl)methyl]pyridin-2-amine is Cc1ccc(CNc2ncccc2F)o1.
What is the InChIKey of 3-fluoro-N-[(5-methylfuran-2-yl)methyl]pyridin-2-amine?
The InChIKey is NKUPJLOFZCLTPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O/c1-8-4-5-9(15-8)7-14-11-10(12)3-2-6-13-11/h2-6H,7H2,1H3,(H,13,14).
What are the key properties of 3-fluoro-N-[(5-methylfuran-2-yl)methyl]pyridin-2-amine?
3-fluoro-N-[(5-methylfuran-2-yl)methyl]pyridin-2-amine has a molecular weight of 206.22 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[(5-methylfuran-2-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 62734741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).