N-ethenyl-7-methyl-N-propan-2-yl-[1]benzofuro[3,2-c]pyridin-6-amine

C17H18N2O — CID 118074680

IUPACN-ethenyl-7-methyl-N-propan-2-yl-[1]benzofuro[3,2-c]pyridin-6-amine
SMILESC=CN(c1c(C)ccc2c1oc1ccncc12)C(C)C
InChIInChI=1S/C17H18N2O/c1-5-19(11(2)3)16-12(4)6-7-13-14-10-18-9-8-15(14)20-17(13)16/h5-11H,1H2,2-4H3
InChIKeyKNRZVYHZKOBDSS-UHFFFAOYSA-N
MW266.34 g/mol
LogP4.65
Rot. Bonds3

About N-ethenyl-7-methyl-N-propan-2-yl-[1]benzofuro[3,2-c]pyridin-6-amine

N-ethenyl-7-methyl-N-propan-2-yl-[1]benzofuro[3,2-c]pyridin-6-amine (PubChem CID 118074680) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is N-ethenyl-7-methyl-N-propan-2-yl-[1]benzofuro[3,2-c]pyridin-6-amine.

Molecular Properties

Compound NameN-ethenyl-7-methyl-N-propan-2-yl-[1]benzofuro[3,2-c]pyridin-6-amine
PubChem CID118074680
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC NameN-ethenyl-7-methyl-N-propan-2-yl-[1]benzofuro[3,2-c]pyridin-6-amine
SMILESC=CN(c1c(C)ccc2c1oc1ccncc12)C(C)C
InChIInChI=1S/C17H18N2O/c1-5-19(11(2)3)16-12(4)6-7-13-14-10-18-9-8-15(14)20-17(13)16/h5-11H,1H2,2-4H3
InChIKeyKNRZVYHZKOBDSS-UHFFFAOYSA-N
XLogP4.65
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethenyl-7-methyl-N-propan-2-yl-[1]benzofuro[3,2-c]pyridin-6-amine?
The IUPAC name of N-ethenyl-7-methyl-N-propan-2-yl-[1]benzofuro[3,2-c]pyridin-6-amine (CID 118074680) is N-ethenyl-7-methyl-N-propan-2-yl-[1]benzofuro[3,2-c]pyridin-6-amine.
What is the SMILES notation for N-ethenyl-7-methyl-N-propan-2-yl-[1]benzofuro[3,2-c]pyridin-6-amine?
The canonical SMILES for N-ethenyl-7-methyl-N-propan-2-yl-[1]benzofuro[3,2-c]pyridin-6-amine is C=CN(c1c(C)ccc2c1oc1ccncc12)C(C)C.
What is the InChIKey of N-ethenyl-7-methyl-N-propan-2-yl-[1]benzofuro[3,2-c]pyridin-6-amine?
The InChIKey is KNRZVYHZKOBDSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-5-19(11(2)3)16-12(4)6-7-13-14-10-18-9-8-15(14)20-17(13)16/h5-11H,1H2,2-4H3.
What are the key properties of N-ethenyl-7-methyl-N-propan-2-yl-[1]benzofuro[3,2-c]pyridin-6-amine?
N-ethenyl-7-methyl-N-propan-2-yl-[1]benzofuro[3,2-c]pyridin-6-amine has a molecular weight of 266.34 g/mol, XLogP of 4.65, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-7-methyl-N-propan-2-yl-[1]benzofuro[3,2-c]pyridin-6-amine is sourced from PubChem (CID 118074680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).