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

C12H14N2O — CID 115735488

IUPAC3-methyl-N-[(3-methylfuran-2-yl)methyl]pyridin-2-amine
SMILESCc1cccnc1NCc1occc1C
InChIInChI=1S/C12H14N2O/c1-9-5-7-15-11(9)8-14-12-10(2)4-3-6-13-12/h3-7H,8H2,1-2H3,(H,13,14)
InChIKeyBLCMDXBTZPHBDK-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.90
Rot. Bonds3

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

3-methyl-N-[(3-methylfuran-2-yl)methyl]pyridin-2-amine (PubChem CID 115735488) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 3-methyl-N-[(3-methylfuran-2-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name3-methyl-N-[(3-methylfuran-2-yl)methyl]pyridin-2-amine
PubChem CID115735488
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name3-methyl-N-[(3-methylfuran-2-yl)methyl]pyridin-2-amine
SMILESCc1cccnc1NCc1occc1C
InChIInChI=1S/C12H14N2O/c1-9-5-7-15-11(9)8-14-12-10(2)4-3-6-13-12/h3-7H,8H2,1-2H3,(H,13,14)
InChIKeyBLCMDXBTZPHBDK-UHFFFAOYSA-N
XLogP2.90
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-methylfuran-2-yl)methyl]quinolin-8-amine
CID 113268147
2-methyl-1-[(3-methyl-2-pyridinyl)amino]propan-2-ol
CID 65109200
N-[(4-ethylphenyl)methyl]-3-methylpyridin-2-amine
CID 82679621
3-methyl-N-(1,3-thiazol-5-ylmethyl)pyridin-2-amine
CID 115735497
N-[(3-methylfuran-2-yl)methyl]-1,3-thiazol-2-amine
CID 115924599
N-(2,2-dimethylbut-3-enyl)-3-methylpyridin-2-amine
CID 130892336
N-[(4-chlorophenyl)methyl]-3-methylpyridin-2-amine
CID 60704947
3-methyl-N-(pyrimidin-5-ylmethyl)pyridin-2-amine
CID 66973402
N-[(2-ethyl-1,3-thiazol-5-yl)methyl]-3-methylpyridin-2-amine
CID 115735496
N-[(3-methylfuran-2-yl)methyl]-2-pyridin-2-ylethanamine
CID 115651235
6-fluoro-N-[(3-methylfuran-2-yl)methyl]pyridin-3-amine
CID 115749492
3-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyridin-2-amine
CID 115867856

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[(3-methylfuran-2-yl)methyl]pyridin-2-amine?
The IUPAC name of 3-methyl-N-[(3-methylfuran-2-yl)methyl]pyridin-2-amine (CID 115735488) is 3-methyl-N-[(3-methylfuran-2-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 3-methyl-N-[(3-methylfuran-2-yl)methyl]pyridin-2-amine?
The canonical SMILES for 3-methyl-N-[(3-methylfuran-2-yl)methyl]pyridin-2-amine is Cc1cccnc1NCc1occc1C.
What is the InChIKey of 3-methyl-N-[(3-methylfuran-2-yl)methyl]pyridin-2-amine?
The InChIKey is BLCMDXBTZPHBDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-9-5-7-15-11(9)8-14-12-10(2)4-3-6-13-12/h3-7H,8H2,1-2H3,(H,13,14).
What are the key properties of 3-methyl-N-[(3-methylfuran-2-yl)methyl]pyridin-2-amine?
3-methyl-N-[(3-methylfuran-2-yl)methyl]pyridin-2-amine has a molecular weight of 202.26 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[(3-methylfuran-2-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 115735488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).