[2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methanamine

C12H15NO — CID 18787377

IUPAC[2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methanamine
SMILESNCC1CC1c1cccc2c1CCO2
InChIInChI=1S/C12H15NO/c13-7-8-6-11(8)9-2-1-3-12-10(9)4-5-14-12/h1-3,8,11H,4-7,13H2
InChIKeyFXYHNSKFBUUONP-UHFFFAOYSA-N
MW189.26 g/mol
LogP1.68
Rot. Bonds2

About [2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methanamine

[2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methanamine (PubChem CID 18787377) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is [2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methanamine.

Molecular Properties

Compound Name[2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methanamine
PubChem CID18787377
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC Name[2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methanamine
SMILESNCC1CC1c1cccc2c1CCO2
InChIInChI=1S/C12H15NO/c13-7-8-6-11(8)9-2-1-3-12-10(9)4-5-14-12/h1-3,8,11H,4-7,13H2
InChIKeyFXYHNSKFBUUONP-UHFFFAOYSA-N
XLogP1.68
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]acetamide
CID 123181605
[2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methanediol
CID 123498759
N-[[2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methyl]-N-methylpropanamide
CID 18787372
4-(bromomethyl)-2,3-dihydro-1-benzofuran
CID 139534248
2-(2,3,4,5-tetrahydro-1-benzoxepin-6-yl)cyclopropane-1-carbaldehyde
CID 18787409
4-(2,3-dihydro-1-benzofuran-4-yl)-1-ethylpiperidine
CID 123608868
[(1R,2R)-2-(2-bromophenyl)cyclopropyl]methanamine;hydrochloride
CID 44572752
2-(2,3-dihydro-1-benzofuran-4-yl)-2,3-dihydro-1,3-benzoxazole
CID 166716951
4-(2,3-dihydro-1-benzofuran-4-yl)butan-1-amine
CID 117282588
1-(2,3-dihydro-1-benzofuran-4-yl)-N,N-dimethylmethanamine
CID 141164132
[3-(2,3-dihydro-1-benzofuran-4-yl)-1,2,4-oxadiazol-5-yl]methanamine
CID 117309097
(3R)-3-(2,3-dihydro-1-benzofuran-4-yl)piperidine
CID 96763066

Frequently Asked Questions

What is the IUPAC name of [2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methanamine?
The IUPAC name of [2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methanamine (CID 18787377) is [2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methanamine.
What is the SMILES notation for [2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methanamine?
The canonical SMILES for [2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methanamine is NCC1CC1c1cccc2c1CCO2.
What is the InChIKey of [2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methanamine?
The InChIKey is FXYHNSKFBUUONP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO/c13-7-8-6-11(8)9-2-1-3-12-10(9)4-5-14-12/h1-3,8,11H,4-7,13H2.
What are the key properties of [2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methanamine?
[2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methanamine has a molecular weight of 189.26 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methanamine is sourced from PubChem (CID 18787377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).