3-N,3-N-dimethyl-3,4-dihydro-2H-chromene-3,8-diamine

C11H16N2O — CID 105446305

IUPAC3-N,3-N-dimethyl-3,4-dihydro-2H-chromene-3,8-diamine
SMILESCN(C)C1COc2c(N)cccc2C1
InChIInChI=1S/C11H16N2O/c1-13(2)9-6-8-4-3-5-10(12)11(8)14-7-9/h3-5,9H,6-7,12H2,1-2H3
InChIKeyZVUYOIISMXDZMS-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.13
Rot. Bonds1

About 3-N,3-N-dimethyl-3,4-dihydro-2H-chromene-3,8-diamine

3-N,3-N-dimethyl-3,4-dihydro-2H-chromene-3,8-diamine (PubChem CID 105446305) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 3-N,3-N-dimethyl-3,4-dihydro-2H-chromene-3,8-diamine.

Molecular Properties

Compound Name3-N,3-N-dimethyl-3,4-dihydro-2H-chromene-3,8-diamine
PubChem CID105446305
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name3-N,3-N-dimethyl-3,4-dihydro-2H-chromene-3,8-diamine
SMILESCN(C)C1COc2c(N)cccc2C1
InChIInChI=1S/C11H16N2O/c1-13(2)9-6-8-4-3-5-10(12)11(8)14-7-9/h3-5,9H,6-7,12H2,1-2H3
InChIKeyZVUYOIISMXDZMS-UHFFFAOYSA-N
XLogP1.13
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 3-N,3-N-dimethyl-3,4-dihydro-2H-chromene-3,8-diamine 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

(3S)-3-N,3-N-dipropyl-3,4-dihydro-2H-chromene-3,8-diamine
CID 129384642
3-piperidin-1-yl-3,4-dihydro-2H-chromen-8-amine
CID 105491696
3-(methoxymethyl)-3,4-dihydro-2H-chromen-8-amine
CID 105447073
(3S)-6,8-dichloro-N,N-dimethyl-3,4-dihydro-2H-chromen-3-amine
CID 97356373
2,3-dihydro-1-benzofuran-7-amine;hydrobromide
CID 168986288
ethyl 2-[[(3S)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]-methylamino]acetate
CID 30921029
(3S)-N,N-dibutyl-8-methoxy-3,4-dihydro-2H-chromen-3-amine
CID 129411882
2,3-dihydro-1,4-benzodioxin-5-amine;ethane
CID 170590929
1-(7-amino-1,3-benzodioxol-4-yl)-N,N-dimethylpiperidin-4-amine
CID 167014557
9-amino-4,5-dihydro-1,4-benzoxazepin-3-one;ethane
CID 145093037
(3R)-8-(4-methoxyphenyl)-N,N-dipropyl-3,4-dihydro-2H-chromen-3-amine
CID 11151958
(2R)-2-N,2-N-dimethyl-2,3-dihydro-1H-indene-2,5-diamine
CID 58289987

Frequently Asked Questions

What is the IUPAC name of 3-N,3-N-dimethyl-3,4-dihydro-2H-chromene-3,8-diamine?
The IUPAC name of 3-N,3-N-dimethyl-3,4-dihydro-2H-chromene-3,8-diamine (CID 105446305) is 3-N,3-N-dimethyl-3,4-dihydro-2H-chromene-3,8-diamine.
What is the SMILES notation for 3-N,3-N-dimethyl-3,4-dihydro-2H-chromene-3,8-diamine?
The canonical SMILES for 3-N,3-N-dimethyl-3,4-dihydro-2H-chromene-3,8-diamine is CN(C)C1COc2c(N)cccc2C1.
What is the InChIKey of 3-N,3-N-dimethyl-3,4-dihydro-2H-chromene-3,8-diamine?
The InChIKey is ZVUYOIISMXDZMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-13(2)9-6-8-4-3-5-10(12)11(8)14-7-9/h3-5,9H,6-7,12H2,1-2H3.
What are the key properties of 3-N,3-N-dimethyl-3,4-dihydro-2H-chromene-3,8-diamine?
3-N,3-N-dimethyl-3,4-dihydro-2H-chromene-3,8-diamine has a molecular weight of 192.26 g/mol, XLogP of 1.13, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,3-N-dimethyl-3,4-dihydro-2H-chromene-3,8-diamine is sourced from PubChem (CID 105446305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).