N-(1-benzofuran-2-ylmethyl)furan-2-amine

C13H11NO2 — CID 69320598

IUPACN-(1-benzofuran-2-ylmethyl)furan-2-amine
SMILESc1coc(NCc2cc3ccccc3o2)c1
InChIInChI=1S/C13H11NO2/c1-2-5-12-10(4-1)8-11(16-12)9-14-13-6-3-7-15-13/h1-8,14H,9H2
InChIKeyKCEYPRMBVPTVSH-UHFFFAOYSA-N
MW213.24 g/mol
LogP3.64
Rot. Bonds3

About N-(1-benzofuran-2-ylmethyl)furan-2-amine

N-(1-benzofuran-2-ylmethyl)furan-2-amine (PubChem CID 69320598) has the molecular formula C13H11NO2 and a molecular weight of 213.24 g/mol. Its IUPAC name is N-(1-benzofuran-2-ylmethyl)furan-2-amine.

Molecular Properties

Compound NameN-(1-benzofuran-2-ylmethyl)furan-2-amine
PubChem CID69320598
Molecular FormulaC13H11NO2
Molecular Weight213.24 g/mol
Exact Mass213.08
IUPAC NameN-(1-benzofuran-2-ylmethyl)furan-2-amine
SMILESc1coc(NCc2cc3ccccc3o2)c1
InChIInChI=1S/C13H11NO2/c1-2-5-12-10(4-1)8-11(16-12)9-14-13-6-3-7-15-13/h1-8,14H,9H2
InChIKeyKCEYPRMBVPTVSH-UHFFFAOYSA-N
XLogP3.64
TPSA38.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-N-(1-benzofuran-2-ylmethyl)-1-(furan-2-yl)ethanamine
CID 81403388
N-(1-benzofuran-2-ylmethyl)-4-methoxyaniline
CID 28619697
N-(1-benzofuran-2-ylmethyl)-2,3,3-trimethylbutan-1-amine
CID 78966709
N-(1-benzofuran-2-ylmethyl)-2,4-dibromoaniline
CID 43683009
CID 156725408
CID 156725408
(1S)-N-(1-benzofuran-2-ylmethyl)-1-phenylethanamine
CID 28609841
(2S)-2-(1-benzofuran-2-ylmethylamino)propan-1-ol
CID 93082461
N-(1-benzofuran-2-ylmethyl)-3-(difluoromethoxy)aniline
CID 43698651
N-(1-benzofuran-2-ylmethyl)quinolin-8-amine
CID 30056544
N-(1-benzofuran-2-ylmethyl)-5-methyl-1,3,4-thiadiazol-2-amine
CID 113240485
N-(1-benzofuran-2-ylmethyl)-5-chloropyridin-2-amine
CID 171680431
N-(1-benzofuran-2-ylmethyl)-2,3-dihydro-1H-inden-5-amine
CID 29037427

Frequently Asked Questions

What is the IUPAC name of N-(1-benzofuran-2-ylmethyl)furan-2-amine?
The IUPAC name of N-(1-benzofuran-2-ylmethyl)furan-2-amine (CID 69320598) is N-(1-benzofuran-2-ylmethyl)furan-2-amine.
What is the SMILES notation for N-(1-benzofuran-2-ylmethyl)furan-2-amine?
The canonical SMILES for N-(1-benzofuran-2-ylmethyl)furan-2-amine is c1coc(NCc2cc3ccccc3o2)c1.
What is the InChIKey of N-(1-benzofuran-2-ylmethyl)furan-2-amine?
The InChIKey is KCEYPRMBVPTVSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11NO2/c1-2-5-12-10(4-1)8-11(16-12)9-14-13-6-3-7-15-13/h1-8,14H,9H2.
What are the key properties of N-(1-benzofuran-2-ylmethyl)furan-2-amine?
N-(1-benzofuran-2-ylmethyl)furan-2-amine has a molecular weight of 213.24 g/mol, XLogP of 3.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzofuran-2-ylmethyl)furan-2-amine is sourced from PubChem (CID 69320598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).