1-(6-methoxy-3,4-dihydro-2H-chromen-7-yl)propan-2-amine

C13H19NO2 — CID 69408234

IUPAC1-(6-methoxy-3,4-dihydro-2H-chromen-7-yl)propan-2-amine
SMILESCOc1cc2c(cc1CC(C)N)OCCC2
InChIInChI=1S/C13H19NO2/c1-9(14)6-11-8-13-10(4-3-5-16-13)7-12(11)15-2/h7-9H,3-6,14H2,1-2H3
InChIKeyVGHASPHTFWANQR-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.91
Rot. Bonds3

About 1-(6-methoxy-3,4-dihydro-2H-chromen-7-yl)propan-2-amine

1-(6-methoxy-3,4-dihydro-2H-chromen-7-yl)propan-2-amine (PubChem CID 69408234) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 1-(6-methoxy-3,4-dihydro-2H-chromen-7-yl)propan-2-amine.

Molecular Properties

Compound Name1-(6-methoxy-3,4-dihydro-2H-chromen-7-yl)propan-2-amine
PubChem CID69408234
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name1-(6-methoxy-3,4-dihydro-2H-chromen-7-yl)propan-2-amine
SMILESCOc1cc2c(cc1CC(C)N)OCCC2
InChIInChI=1S/C13H19NO2/c1-9(14)6-11-8-13-10(4-3-5-16-13)7-12(11)15-2/h7-9H,3-6,14H2,1-2H3
InChIKeyVGHASPHTFWANQR-UHFFFAOYSA-N
XLogP1.91
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(6-methoxy-3,4-dihydro-2H-chromen-7-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

(6-methoxy-3,4-dihydro-2H-chromen-7-yl)methanol
CID 10241724
1-(5-ethoxy-2,3-dihydro-1-benzofuran-6-yl)propan-2-amine
CID 83890043
3-(6-methoxy-3,4-dihydro-2H-chromen-7-yl)-N,N-dimethylpropan-1-amine
CID 170865622
N-[(5-methoxy-2,3-dihydro-1-benzofuran-6-yl)methyl]hydroxylamine
CID 82606137
1-(6-methoxy-2,3-dihydro-1H-inden-5-yl)butan-2-amine
CID 170890550
6-[1-(3-ethyl-4-methoxyphenyl)ethyl]-3,4-dihydro-2H-chromene
CID 145129554
1-(6-methoxy-4H-1,3-benzodioxin-7-yl)propan-2-ol
CID 117321804
1-(8-chloro-7-methoxy-3,4-dihydro-2H-1,5-benzodioxepin-6-yl)propan-2-amine
CID 117432311
1-[2,5-dimethoxy-4-(oxolan-2-ylmethyl)phenyl]propan-2-amine;hydrochloride
CID 69399771
(2S)-1-(2,5-dimethoxy-4-propylphenyl)propan-2-amine
CID 121489695
(2S)-1-(4-bromo-2,5-dimethoxyphenyl)propan-2-amine;hydrobromide
CID 102602641
7-(2-aminopropyl)-2,3-dihydro-1,4-benzodioxin-6-ol
CID 117298618

Frequently Asked Questions

What is the IUPAC name of 1-(6-methoxy-3,4-dihydro-2H-chromen-7-yl)propan-2-amine?
The IUPAC name of 1-(6-methoxy-3,4-dihydro-2H-chromen-7-yl)propan-2-amine (CID 69408234) is 1-(6-methoxy-3,4-dihydro-2H-chromen-7-yl)propan-2-amine.
What is the SMILES notation for 1-(6-methoxy-3,4-dihydro-2H-chromen-7-yl)propan-2-amine?
The canonical SMILES for 1-(6-methoxy-3,4-dihydro-2H-chromen-7-yl)propan-2-amine is COc1cc2c(cc1CC(C)N)OCCC2.
What is the InChIKey of 1-(6-methoxy-3,4-dihydro-2H-chromen-7-yl)propan-2-amine?
The InChIKey is VGHASPHTFWANQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-9(14)6-11-8-13-10(4-3-5-16-13)7-12(11)15-2/h7-9H,3-6,14H2,1-2H3.
What are the key properties of 1-(6-methoxy-3,4-dihydro-2H-chromen-7-yl)propan-2-amine?
1-(6-methoxy-3,4-dihydro-2H-chromen-7-yl)propan-2-amine has a molecular weight of 221.30 g/mol, XLogP of 1.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methoxy-3,4-dihydro-2H-chromen-7-yl)propan-2-amine is sourced from PubChem (CID 69408234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).