1-cyclopropyl-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)ethanamine

C14H19NO — CID 79227058

IUPAC1-cyclopropyl-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)ethanamine
SMILESCC(NCC1COc2ccccc21)C1CC1
InChIInChI=1S/C14H19NO/c1-10(11-6-7-11)15-8-12-9-16-14-5-3-2-4-13(12)14/h2-5,10-12,15H,6-9H2,1H3
InChIKeyPBYQADRKTLCCGD-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.55
Rot. Bonds4

About 1-cyclopropyl-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)ethanamine

1-cyclopropyl-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)ethanamine (PubChem CID 79227058) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 1-cyclopropyl-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)ethanamine
PubChem CID79227058
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name1-cyclopropyl-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)ethanamine
SMILESCC(NCC1COc2ccccc21)C1CC1
InChIInChI=1S/C14H19NO/c1-10(11-6-7-11)15-8-12-9-16-14-5-3-2-4-13(12)14/h2-5,10-12,15H,6-9H2,1H3
InChIKeyPBYQADRKTLCCGD-UHFFFAOYSA-N
XLogP2.55
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-cyclopentyl-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)ethanamine
CID 81395215
1-cyclopropyl-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)butan-2-amine
CID 79226758
N-(2,3-dihydro-1-benzofuran-3-ylmethyl)hexan-3-amine
CID 79226351
(2R)-2-(2,3-dihydro-1-benzofuran-3-ylmethylamino)propanoic acid
CID 83194430
N-(2,3-dihydro-1-benzofuran-3-ylmethyl)-1-iodo-3-methylbutan-2-amine
CID 107859372
(1S)-1-(2-bromophenyl)-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)ethanamine
CID 81383137
ethyl 2-(2,3-dihydro-1-benzofuran-3-ylmethylamino)propanoate
CID 79226267
(1R)-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)-1-(3-fluorophenyl)ethanamine
CID 81365124
N-(2,3-dihydro-1-benzofuran-3-ylmethyl)-1-(3,5-dimethyl-1,2-oxazol-4-yl)ethanamine
CID 79241606
N-(2,3-dihydro-1-benzofuran-3-ylmethyl)methanesulfonamide
CID 110751798
3-(2,3-dihydro-1-benzofuran-3-yl)-2-methyl-N-propan-2-ylpropan-1-amine
CID 79229188
1-cyclohexyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)ethanamine
CID 43769170

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)ethanamine?
The IUPAC name of 1-cyclopropyl-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)ethanamine (CID 79227058) is 1-cyclopropyl-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)ethanamine.
What is the SMILES notation for 1-cyclopropyl-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)ethanamine?
The canonical SMILES for 1-cyclopropyl-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)ethanamine is CC(NCC1COc2ccccc21)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)ethanamine?
The InChIKey is PBYQADRKTLCCGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-10(11-6-7-11)15-8-12-9-16-14-5-3-2-4-13(12)14/h2-5,10-12,15H,6-9H2,1H3.
What are the key properties of 1-cyclopropyl-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)ethanamine?
1-cyclopropyl-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)ethanamine has a molecular weight of 217.31 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)ethanamine is sourced from PubChem (CID 79227058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).