1-cyclohexyl-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]ethanamine

C19H29NO — CID 64508824

IUPAC1-cyclohexyl-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]ethanamine
SMILESCC(NCc1cccc2c1OC(C)(C)C2)C1CCCCC1
InChIInChI=1S/C19H29NO/c1-14(15-8-5-4-6-9-15)20-13-17-11-7-10-16-12-19(2,3)21-18(16)17/h7,10-11,14-15,20H,4-6,8-9,12-13H2,1-3H3
InChIKeyRHKGKGLEOIHQMK-UHFFFAOYSA-N
MW287.45 g/mol
LogP4.46
Rot. Bonds4

About 1-cyclohexyl-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]ethanamine

1-cyclohexyl-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]ethanamine (PubChem CID 64508824) has the molecular formula C19H29NO and a molecular weight of 287.45 g/mol. Its IUPAC name is 1-cyclohexyl-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]ethanamine.

Molecular Properties

Compound Name1-cyclohexyl-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]ethanamine
PubChem CID64508824
Molecular FormulaC19H29NO
Molecular Weight287.45 g/mol
Exact Mass287.22
IUPAC Name1-cyclohexyl-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]ethanamine
SMILESCC(NCc1cccc2c1OC(C)(C)C2)C1CCCCC1
InChIInChI=1S/C19H29NO/c1-14(15-8-5-4-6-9-15)20-13-17-11-7-10-16-12-19(2,3)21-18(16)17/h7,10-11,14-15,20H,4-6,8-9,12-13H2,1-3H3
InChIKeyRHKGKGLEOIHQMK-UHFFFAOYSA-N
XLogP4.46
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.45
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-cyclohexyl-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]ethanamine 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

1,1-dicyclopropyl-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]methanamine
CID 64508357
N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]cyclohexanamine
CID 64509473
2-cyclopentyl-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]ethanamine
CID 64507929
N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]hexan-2-amine
CID 64508402
2-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]-1-N,1-N-diethylpropane-1,2-diamine
CID 64508400
N-(1,3-benzodioxol-4-ylmethyl)-1-cyclopentylethanamine
CID 62634107
N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]thian-4-amine
CID 115641639
N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]-3-methylcyclohexan-1-amine
CID 64506591
N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]-1-thiophen-3-ylethanamine
CID 64508623
1-cyclohexyl-N-(naphthalen-1-ylmethyl)ethanamine
CID 63477824
N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]-1-(thian-2-yl)methanamine
CID 80600345
1-(2,2-dimethyl-3H-1-benzofuran-7-yl)propan-2-amine
CID 64508577

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]ethanamine?
The IUPAC name of 1-cyclohexyl-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]ethanamine (CID 64508824) is 1-cyclohexyl-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]ethanamine.
What is the SMILES notation for 1-cyclohexyl-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]ethanamine?
The canonical SMILES for 1-cyclohexyl-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]ethanamine is CC(NCc1cccc2c1OC(C)(C)C2)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]ethanamine?
The InChIKey is RHKGKGLEOIHQMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29NO/c1-14(15-8-5-4-6-9-15)20-13-17-11-7-10-16-12-19(2,3)21-18(16)17/h7,10-11,14-15,20H,4-6,8-9,12-13H2,1-3H3.
What are the key properties of 1-cyclohexyl-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]ethanamine?
1-cyclohexyl-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]ethanamine has a molecular weight of 287.45 g/mol, XLogP of 4.46, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]ethanamine is sourced from PubChem (CID 64508824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).