N-(furan-2-ylmethyl)-2-methyl-6-pyridin-4-ylpyrimidin-4-amine

C15H14N4O — CID 3657838

IUPACN-(furan-2-ylmethyl)-2-methyl-6-pyridin-4-ylpyrimidin-4-amine
SMILESCc1nc(NCc2ccco2)cc(-c2ccncc2)n1
InChIInChI=1S/C15H14N4O/c1-11-18-14(12-4-6-16-7-5-12)9-15(19-11)17-10-13-3-2-8-20-13/h2-9H,10H2,1H3,(H,17,18,19)
InChIKeyMMUKFUPSPYBKQA-UHFFFAOYSA-N
MW266.30 g/mol
LogP3.05
Rot. Bonds4

About N-(furan-2-ylmethyl)-2-methyl-6-pyridin-4-ylpyrimidin-4-amine

N-(furan-2-ylmethyl)-2-methyl-6-pyridin-4-ylpyrimidin-4-amine (PubChem CID 3657838) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-methyl-6-pyridin-4-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-methyl-6-pyridin-4-ylpyrimidin-4-amine
PubChem CID3657838
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC NameN-(furan-2-ylmethyl)-2-methyl-6-pyridin-4-ylpyrimidin-4-amine
SMILESCc1nc(NCc2ccco2)cc(-c2ccncc2)n1
InChIInChI=1S/C15H14N4O/c1-11-18-14(12-4-6-16-7-5-12)9-15(19-11)17-10-13-3-2-8-20-13/h2-9H,10H2,1H3,(H,17,18,19)
InChIKeyMMUKFUPSPYBKQA-UHFFFAOYSA-N
XLogP3.05
TPSA63.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-(furan-2-ylmethyl)-6-methyl-2-N-(pyridin-4-ylmethyl)pyrimidine-2,4-diamine
CID 112915129
4-N-(2,6-dimethylphenyl)-6-N-(furan-2-ylmethyl)-2-methylpyrimidine-4,6-diamine
CID 112871390
4-N-(furan-2-ylmethyl)-6-phenyl-2-N-propylpyrimidine-2,4-diamine
CID 112932522
N-(furan-2-ylmethyl)-6-phenyl-2-pyridin-2-ylpyrimidin-4-amine
CID 3314360
4-N-(furan-2-ylmethyl)-6-phenyl-2-N-propan-2-ylpyrimidine-2,4-diamine
CID 112932798
2-N-(furan-2-ylmethyl)-4-N-(2-methylpropyl)-6-phenylpyrimidine-2,4-diamine
CID 112933719
N-benzyl-2-methyl-6-phenylpyrimidin-4-amine
CID 16957885
6-N-(furan-2-ylmethyl)-4-N-(4-methoxyphenyl)-2-methylpyrimidine-4,6-diamine
CID 112871420
4-N-(2-ethyl-6-methylphenyl)-6-N-(furan-2-ylmethyl)-2-methylpyrimidine-4,6-diamine
CID 112871395
4-N-(furan-2-ylmethyl)-6-phenyl-2-N-(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 112936733
4-N-(2-ethylphenyl)-6-N-(furan-2-ylmethyl)-2-methylpyrimidine-4,6-diamine
CID 112871392
N-(furan-2-ylmethyl)-2-phenyl-6-(5-phenyl-3-pyridinyl)pyrimidin-4-amine
CID 4099468

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-methyl-6-pyridin-4-ylpyrimidin-4-amine?
The IUPAC name of N-(furan-2-ylmethyl)-2-methyl-6-pyridin-4-ylpyrimidin-4-amine (CID 3657838) is N-(furan-2-ylmethyl)-2-methyl-6-pyridin-4-ylpyrimidin-4-amine.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-methyl-6-pyridin-4-ylpyrimidin-4-amine?
The canonical SMILES for N-(furan-2-ylmethyl)-2-methyl-6-pyridin-4-ylpyrimidin-4-amine is Cc1nc(NCc2ccco2)cc(-c2ccncc2)n1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-methyl-6-pyridin-4-ylpyrimidin-4-amine?
The InChIKey is MMUKFUPSPYBKQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c1-11-18-14(12-4-6-16-7-5-12)9-15(19-11)17-10-13-3-2-8-20-13/h2-9H,10H2,1H3,(H,17,18,19).
What are the key properties of N-(furan-2-ylmethyl)-2-methyl-6-pyridin-4-ylpyrimidin-4-amine?
N-(furan-2-ylmethyl)-2-methyl-6-pyridin-4-ylpyrimidin-4-amine has a molecular weight of 266.30 g/mol, XLogP of 3.05, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-methyl-6-pyridin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 3657838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).