[5-(5-methyl-3-pyridinyl)furan-3-yl]methanamine

C11H12N2O — CID 131067592

IUPAC[5-(5-methyl-3-pyridinyl)furan-3-yl]methanamine
SMILESCc1cncc(-c2cc(CN)co2)c1
InChIInChI=1S/C11H12N2O/c1-8-2-10(6-13-5-8)11-3-9(4-12)7-14-11/h2-3,5-7H,4,12H2,1H3
InChIKeyKUGLMDYJOTYPOC-UHFFFAOYSA-N
MW188.23 g/mol
LogP2.11
Rot. Bonds2

About [5-(5-methyl-3-pyridinyl)furan-3-yl]methanamine

[5-(5-methyl-3-pyridinyl)furan-3-yl]methanamine (PubChem CID 131067592) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is [5-(5-methyl-3-pyridinyl)furan-3-yl]methanamine.

Molecular Properties

Compound Name[5-(5-methyl-3-pyridinyl)furan-3-yl]methanamine
PubChem CID131067592
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name[5-(5-methyl-3-pyridinyl)furan-3-yl]methanamine
SMILESCc1cncc(-c2cc(CN)co2)c1
InChIInChI=1S/C11H12N2O/c1-8-2-10(6-13-5-8)11-3-9(4-12)7-14-11/h2-3,5-7H,4,12H2,1H3
InChIKeyKUGLMDYJOTYPOC-UHFFFAOYSA-N
XLogP2.11
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[5-(5-methylthiophen-3-yl)furan-3-yl]methanamine
CID 130719372
[5-(3-methylthiophen-2-yl)furan-3-yl]methanamine
CID 130643799
N-[4-(aminomethyl)phenyl]-5-methylpyridin-3-amine
CID 145472983
ethane;5-(5-methyl-3-pyridinyl)-1,2-oxazol-3-one
CID 145106828
3-(2,6-dimethylphenyl)-5-methylpyridine
CID 146182914
CID 174996178
CID 174996178
3-(4-ethyl-1,2,4-triazol-3-yl)-5-methylpyridine
CID 115394647
4-[(5-methyl-3-pyridinyl)methyl]-1,3-oxazole
CID 90964677
5-(5-methyl-3-pyridinyl)pyridin-2-amine
CID 115375024
5-(5-methyl-3-pyridinyl)-1H-pyrazol-3-amine
CID 65438735
2-iodo-5-(5-methyl-3-pyridinyl)-1,3,4-oxadiazole
CID 114771871
3-methyl-5-(4-methylphenyl)pyridine;4-(4-methylphenyl)pyridine
CID 143453970

Frequently Asked Questions

What is the IUPAC name of [5-(5-methyl-3-pyridinyl)furan-3-yl]methanamine?
The IUPAC name of [5-(5-methyl-3-pyridinyl)furan-3-yl]methanamine (CID 131067592) is [5-(5-methyl-3-pyridinyl)furan-3-yl]methanamine.
What is the SMILES notation for [5-(5-methyl-3-pyridinyl)furan-3-yl]methanamine?
The canonical SMILES for [5-(5-methyl-3-pyridinyl)furan-3-yl]methanamine is Cc1cncc(-c2cc(CN)co2)c1.
What is the InChIKey of [5-(5-methyl-3-pyridinyl)furan-3-yl]methanamine?
The InChIKey is KUGLMDYJOTYPOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-8-2-10(6-13-5-8)11-3-9(4-12)7-14-11/h2-3,5-7H,4,12H2,1H3.
What are the key properties of [5-(5-methyl-3-pyridinyl)furan-3-yl]methanamine?
[5-(5-methyl-3-pyridinyl)furan-3-yl]methanamine has a molecular weight of 188.23 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(5-methyl-3-pyridinyl)furan-3-yl]methanamine is sourced from PubChem (CID 131067592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).