2,3,5-trimethyl-7-propan-2-ylfuro[3,4-b]pyridin-4-amine

C13H18N2O — CID 160986122

IUPAC2,3,5-trimethyl-7-propan-2-ylfuro[3,4-b]pyridin-4-amine
SMILESCc1nc2c(C(C)C)oc(C)c2c(N)c1C
InChIInChI=1S/C13H18N2O/c1-6(2)13-12-10(9(5)16-13)11(14)7(3)8(4)15-12/h6H,14H2,1-5H3
InChIKeyJDBXBAHNBPYWBN-UHFFFAOYSA-N
MW218.30 g/mol
LogP3.46
Rot. Bonds1

About 2,3,5-trimethyl-7-propan-2-ylfuro[3,4-b]pyridin-4-amine

2,3,5-trimethyl-7-propan-2-ylfuro[3,4-b]pyridin-4-amine (PubChem CID 160986122) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 2,3,5-trimethyl-7-propan-2-ylfuro[3,4-b]pyridin-4-amine.

Molecular Properties

Compound Name2,3,5-trimethyl-7-propan-2-ylfuro[3,4-b]pyridin-4-amine
PubChem CID160986122
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name2,3,5-trimethyl-7-propan-2-ylfuro[3,4-b]pyridin-4-amine
SMILESCc1nc2c(C(C)C)oc(C)c2c(N)c1C
InChIInChI=1S/C13H18N2O/c1-6(2)13-12-10(9(5)16-13)11(14)7(3)8(4)15-12/h6H,14H2,1-5H3
InChIKeyJDBXBAHNBPYWBN-UHFFFAOYSA-N
XLogP3.46
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,3,4,5,6,7-hexamethyl-8-propan-2-ylquinoline
CID 157183613
1-(4-methyl-5-propan-2-yl-1,3-oxazol-2-yl)ethanamine
CID 115013442
2,3,5,6,7-pentamethyl-8-propan-2-ylquinoxaline
CID 157183608
8-bromo-2,6-dimethyl-3-propan-2-ylquinolin-4-amine
CID 62914764
5,8-dibromo-2,3-dimethylquinoxaline-6,7-diamine
CID 164530828
4,6,7-trimethyl-2-propan-2-yl-[1,3]oxazolo[5,4-c]pyridine
CID 58519669
4-methyl-5-propan-2-yl-2-propyl-1,3-oxazole
CID 134224934
2-methoxy-4-methyl-5-propan-2-yl-1,3-oxazole
CID 134224933
4-methyl-2-methylsulfanyl-5-propan-2-yl-1,3-oxazole
CID 134224932
5,6-dimethyl-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine;ethane
CID 142280410
3-fluoro-5,6-dimethyl-4-propan-2-ylpyridin-2-amine
CID 175624755
4-(2-methyl-5-propan-2-yl-1,3-oxazol-4-yl)aniline
CID 83887171

Frequently Asked Questions

What is the IUPAC name of 2,3,5-trimethyl-7-propan-2-ylfuro[3,4-b]pyridin-4-amine?
The IUPAC name of 2,3,5-trimethyl-7-propan-2-ylfuro[3,4-b]pyridin-4-amine (CID 160986122) is 2,3,5-trimethyl-7-propan-2-ylfuro[3,4-b]pyridin-4-amine.
What is the SMILES notation for 2,3,5-trimethyl-7-propan-2-ylfuro[3,4-b]pyridin-4-amine?
The canonical SMILES for 2,3,5-trimethyl-7-propan-2-ylfuro[3,4-b]pyridin-4-amine is Cc1nc2c(C(C)C)oc(C)c2c(N)c1C.
What is the InChIKey of 2,3,5-trimethyl-7-propan-2-ylfuro[3,4-b]pyridin-4-amine?
The InChIKey is JDBXBAHNBPYWBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-6(2)13-12-10(9(5)16-13)11(14)7(3)8(4)15-12/h6H,14H2,1-5H3.
What are the key properties of 2,3,5-trimethyl-7-propan-2-ylfuro[3,4-b]pyridin-4-amine?
2,3,5-trimethyl-7-propan-2-ylfuro[3,4-b]pyridin-4-amine has a molecular weight of 218.30 g/mol, XLogP of 3.46, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5-trimethyl-7-propan-2-ylfuro[3,4-b]pyridin-4-amine is sourced from PubChem (CID 160986122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).