1-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propan-2-amine

C14H21NO — CID 117313385

IUPAC1-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propan-2-amine
SMILESCC(N)Cc1cccc2c1OC(C)(C)CC2
InChIInChI=1S/C14H21NO/c1-10(15)9-12-6-4-5-11-7-8-14(2,3)16-13(11)12/h4-6,10H,7-9,15H2,1-3H3
InChIKeyYVZKUJQTGXFGDL-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.68
Rot. Bonds2

About 1-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propan-2-amine

1-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propan-2-amine (PubChem CID 117313385) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propan-2-amine.

Molecular Properties

Compound Name1-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propan-2-amine
PubChem CID117313385
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name1-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propan-2-amine
SMILESCC(N)Cc1cccc2c1OC(C)(C)CC2
InChIInChI=1S/C14H21NO/c1-10(15)9-12-6-4-5-11-7-8-14(2,3)16-13(11)12/h4-6,10H,7-9,15H2,1-3H3
InChIKeyYVZKUJQTGXFGDL-UHFFFAOYSA-N
XLogP2.68
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propan-2-amine 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-(2,2-dimethyl-3H-1-benzofuran-7-yl)propan-2-amine
CID 64508577
1-(2,2-dimethyl-3,4-dihydrochromen-8-yl)ethanamine
CID 84673537
3-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propanal
CID 117311200
3-amino-3-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propan-1-ol
CID 84698811
(2,2-dimethyl-3H-1-benzofuran-7-yl)methanamine
CID 18525713
3-(2,2-dimethyl-3,4-dihydrochromen-8-yl)-2,2-dimethylpropanoic acid
CID 117410558
1-(2,2-dimethyl-1,3-benzoxathiol-7-yl)propan-2-amine
CID 117320813
3-amino-1-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propan-1-ol
CID 84698810
2-(aminomethyl)-3-(2,2-dimethyl-3H-1-benzofuran-7-yl)propan-1-ol
CID 64508349
3-amino-2-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propanoic acid
CID 117376381
1-[1-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]piperidin-4-yl]ethanamine
CID 64509728
1-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]cyclopropan-1-ol
CID 117311226

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propan-2-amine?
The IUPAC name of 1-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propan-2-amine (CID 117313385) is 1-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propan-2-amine.
What is the SMILES notation for 1-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propan-2-amine?
The canonical SMILES for 1-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propan-2-amine is CC(N)Cc1cccc2c1OC(C)(C)CC2.
What is the InChIKey of 1-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propan-2-amine?
The InChIKey is YVZKUJQTGXFGDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-10(15)9-12-6-4-5-11-7-8-14(2,3)16-13(11)12/h4-6,10H,7-9,15H2,1-3H3.
What are the key properties of 1-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propan-2-amine?
1-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propan-2-amine has a molecular weight of 219.33 g/mol, XLogP of 2.68, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propan-2-amine is sourced from PubChem (CID 117313385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).