N-(furan-3-ylmethyl)-2-methylpyrimidin-4-amine

C10H11N3O — CID 115657207

IUPACN-(furan-3-ylmethyl)-2-methylpyrimidin-4-amine
SMILESCc1nccc(NCc2ccoc2)n1
InChIInChI=1S/C10H11N3O/c1-8-11-4-2-10(13-8)12-6-9-3-5-14-7-9/h2-5,7H,6H2,1H3,(H,11,12,13)
InChIKeyBHLBOMHHXOLWCE-UHFFFAOYSA-N
MW189.22 g/mol
LogP1.99
Rot. Bonds3

About N-(furan-3-ylmethyl)-2-methylpyrimidin-4-amine

N-(furan-3-ylmethyl)-2-methylpyrimidin-4-amine (PubChem CID 115657207) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is N-(furan-3-ylmethyl)-2-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(furan-3-ylmethyl)-2-methylpyrimidin-4-amine
PubChem CID115657207
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC NameN-(furan-3-ylmethyl)-2-methylpyrimidin-4-amine
SMILESCc1nccc(NCc2ccoc2)n1
InChIInChI=1S/C10H11N3O/c1-8-11-4-2-10(13-8)12-6-9-3-5-14-7-9/h2-5,7H,6H2,1H3,(H,11,12,13)
InChIKeyBHLBOMHHXOLWCE-UHFFFAOYSA-N
XLogP1.99
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(furan-3-ylmethyl)pyrazin-2-amine
CID 115586141
ethane;2-methyl-N-[(4-methylsulfanylphenyl)methyl]pyrimidin-4-amine
CID 143029279
2-methyl-N-(1H-pyrazol-4-ylmethyl)pyrimidin-4-amine
CID 62784731
2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]pyrimidin-4-amine
CID 62784912
2-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidin-4-amine
CID 103736691
N-(2-fluoroethyl)-2-methylpyrimidin-4-amine
CID 130478085
N-(furan-3-ylmethyl)-6-methoxypyrazin-2-amine
CID 155403140
2-methyl-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine
CID 55112812
N-(furan-3-ylmethyl)-2,6-dimethylaniline
CID 115749450
N-(2,2-dimethylbutyl)-2-methylpyrimidin-4-amine
CID 103462611
N-butyl-2-methylpyrimidin-4-amine
CID 62785690
2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyrimidin-4-amine
CID 62784735

Frequently Asked Questions

What is the IUPAC name of N-(furan-3-ylmethyl)-2-methylpyrimidin-4-amine?
The IUPAC name of N-(furan-3-ylmethyl)-2-methylpyrimidin-4-amine (CID 115657207) is N-(furan-3-ylmethyl)-2-methylpyrimidin-4-amine.
What is the SMILES notation for N-(furan-3-ylmethyl)-2-methylpyrimidin-4-amine?
The canonical SMILES for N-(furan-3-ylmethyl)-2-methylpyrimidin-4-amine is Cc1nccc(NCc2ccoc2)n1.
What is the InChIKey of N-(furan-3-ylmethyl)-2-methylpyrimidin-4-amine?
The InChIKey is BHLBOMHHXOLWCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c1-8-11-4-2-10(13-8)12-6-9-3-5-14-7-9/h2-5,7H,6H2,1H3,(H,11,12,13).
What are the key properties of N-(furan-3-ylmethyl)-2-methylpyrimidin-4-amine?
N-(furan-3-ylmethyl)-2-methylpyrimidin-4-amine has a molecular weight of 189.22 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-3-ylmethyl)-2-methylpyrimidin-4-amine is sourced from PubChem (CID 115657207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).