[1-(2,3-dihydro-1-benzofuran-5-yl)-2,2-dimethylcyclopropyl]methanamine

C14H19NO — CID 83705415

IUPAC[1-(2,3-dihydro-1-benzofuran-5-yl)-2,2-dimethylcyclopropyl]methanamine
SMILESCC1(C)CC1(CN)c1ccc2c(c1)CCO2
InChIInChI=1S/C14H19NO/c1-13(2)8-14(13,9-15)11-3-4-12-10(7-11)5-6-16-12/h3-4,7H,5-6,8-9,15H2,1-2H3
InChIKeyAOBVCPKOCOBZRS-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.25
Rot. Bonds2

About [1-(2,3-dihydro-1-benzofuran-5-yl)-2,2-dimethylcyclopropyl]methanamine

[1-(2,3-dihydro-1-benzofuran-5-yl)-2,2-dimethylcyclopropyl]methanamine (PubChem CID 83705415) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is [1-(2,3-dihydro-1-benzofuran-5-yl)-2,2-dimethylcyclopropyl]methanamine.

Molecular Properties

Compound Name[1-(2,3-dihydro-1-benzofuran-5-yl)-2,2-dimethylcyclopropyl]methanamine
PubChem CID83705415
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name[1-(2,3-dihydro-1-benzofuran-5-yl)-2,2-dimethylcyclopropyl]methanamine
SMILESCC1(C)CC1(CN)c1ccc2c(c1)CCO2
InChIInChI=1S/C14H19NO/c1-13(2)8-14(13,9-15)11-3-4-12-10(7-11)5-6-16-12/h3-4,7H,5-6,8-9,15H2,1-2H3
InChIKeyAOBVCPKOCOBZRS-UHFFFAOYSA-N
XLogP2.25
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [1-(2,3-dihydro-1-benzofuran-5-yl)-2,2-dimethylcyclopropyl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(2,3-dihydro-1-benzofuran-5-yl)cyclobutyl]methanamine
CID 82608645
[3-(2,3-dihydro-1-benzofuran-5-yl)oxetan-3-yl]methanamine
CID 116829665
2-[3-(2,3-dihydro-1-benzofuran-5-yl)oxetan-3-yl]-2-methylpropan-1-amine
CID 116869948
1-(2,3-dihydro-1-benzofuran-5-yl)-4,4-dimethylcyclohexan-1-ol
CID 104542080
[1-(2,3-dihydro-1-benzofuran-5-ylmethyl)cyclopropyl]methanamine
CID 116929020
3-[3-(2,3-dihydro-1-benzofuran-5-yl)oxetan-3-yl]-2-methylpropan-1-amine
CID 116870294
ethyl 3-(2,3-dihydro-1-benzofuran-5-yl)-3-methyloxirane-2-carboxylate
CID 116862271
1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-2,2-dimethylcyclohexan-1-amine
CID 79836809
[1-(2,3-dihydro-1-benzofuran-5-yl)cyclopropyl]methanol
CID 105426415
1-(2,3-dihydro-1-benzofuran-5-yl)cycloheptan-1-amine
CID 104542199
2-(2,3-dihydro-1-benzofuran-5-yl)-2-methylpiperazine
CID 116856338
[1-(2,3-dihydro-1-benzofuran-5-ylmethyl)cyclobutyl]methanamine
CID 116929348

Frequently Asked Questions

What is the IUPAC name of [1-(2,3-dihydro-1-benzofuran-5-yl)-2,2-dimethylcyclopropyl]methanamine?
The IUPAC name of [1-(2,3-dihydro-1-benzofuran-5-yl)-2,2-dimethylcyclopropyl]methanamine (CID 83705415) is [1-(2,3-dihydro-1-benzofuran-5-yl)-2,2-dimethylcyclopropyl]methanamine.
What is the SMILES notation for [1-(2,3-dihydro-1-benzofuran-5-yl)-2,2-dimethylcyclopropyl]methanamine?
The canonical SMILES for [1-(2,3-dihydro-1-benzofuran-5-yl)-2,2-dimethylcyclopropyl]methanamine is CC1(C)CC1(CN)c1ccc2c(c1)CCO2.
What is the InChIKey of [1-(2,3-dihydro-1-benzofuran-5-yl)-2,2-dimethylcyclopropyl]methanamine?
The InChIKey is AOBVCPKOCOBZRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-13(2)8-14(13,9-15)11-3-4-12-10(7-11)5-6-16-12/h3-4,7H,5-6,8-9,15H2,1-2H3.
What are the key properties of [1-(2,3-dihydro-1-benzofuran-5-yl)-2,2-dimethylcyclopropyl]methanamine?
[1-(2,3-dihydro-1-benzofuran-5-yl)-2,2-dimethylcyclopropyl]methanamine has a molecular weight of 217.31 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,3-dihydro-1-benzofuran-5-yl)-2,2-dimethylcyclopropyl]methanamine is sourced from PubChem (CID 83705415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).