2,5-dimethyl-8-propan-2-yl-3,4-dihydro-2H-chromen-4-amine

C14H21NO — CID 43537284

IUPAC2,5-dimethyl-8-propan-2-yl-3,4-dihydro-2H-chromen-4-amine
SMILESCc1ccc(C(C)C)c2c1C(N)CC(C)O2
InChIInChI=1S/C14H21NO/c1-8(2)11-6-5-9(3)13-12(15)7-10(4)16-14(11)13/h5-6,8,10,12H,7,15H2,1-4H3
InChIKeyCMNMCUCHMVFLGR-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.29
Rot. Bonds1

About 2,5-dimethyl-8-propan-2-yl-3,4-dihydro-2H-chromen-4-amine

2,5-dimethyl-8-propan-2-yl-3,4-dihydro-2H-chromen-4-amine (PubChem CID 43537284) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 2,5-dimethyl-8-propan-2-yl-3,4-dihydro-2H-chromen-4-amine.

Molecular Properties

Compound Name2,5-dimethyl-8-propan-2-yl-3,4-dihydro-2H-chromen-4-amine
PubChem CID43537284
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name2,5-dimethyl-8-propan-2-yl-3,4-dihydro-2H-chromen-4-amine
SMILESCc1ccc(C(C)C)c2c1C(N)CC(C)O2
InChIInChI=1S/C14H21NO/c1-8(2)11-6-5-9(3)13-12(15)7-10(4)16-14(11)13/h5-6,8,10,12H,7,15H2,1-4H3
InChIKeyCMNMCUCHMVFLGR-UHFFFAOYSA-N
XLogP3.29
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5,8-dichloro-2-methyl-3,4-dihydro-2H-chromen-4-amine
CID 43537153
8-methyl-5-propan-2-yl-2,3-dihydro-1,4-benzodioxine
CID 12621940
4-amino-6-methyl-9-propan-2-yl-3,4-dihydro-2H-1-benzoxepin-5-one;hydrochloride
CID 82247391
8-methyl-5-propan-2-yl-1,4-benzodioxine
CID 145358856
(1S)-4,5,8-trimethyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115417474
7-methyl-2-(7-methyl-4-propan-2-yl-1,3,2-benzodioxaborol-2-yl)-4-propan-2-yl-1,3,2-benzodioxaborole
CID 101380524
(2R,4S)-5,6-difluoro-2-methyl-3,4-dihydro-2H-chromen-4-amine;hydrochloride
CID 164603352
bromomethane;5,13,21-trimethyl-8,16,24-tri(propan-2-yl)-2,10,18-trioxatetracyclo[18.4.0.04,9.012,17]tetracosa-1(24),4,6,8,12,14,16,20,22-nonaene-3,11,19-trione
CID 131720578
8-ethoxy-2-methyl-3,4-dihydro-2H-chromen-4-amine
CID 43537163
4,9-dimethyl-1,3-di(propan-2-yl)-2,3-dihydro-1H-phenalene
CID 147875383
(1R,2R,3R)-3,8-dimethyl-5-propan-2-yl-1,2,3,4-tetrahydronaphthalene-1,2-diol
CID 10059931
6-methyl-9-propan-2-yl-N-propyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine
CID 43512627

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-8-propan-2-yl-3,4-dihydro-2H-chromen-4-amine?
The IUPAC name of 2,5-dimethyl-8-propan-2-yl-3,4-dihydro-2H-chromen-4-amine (CID 43537284) is 2,5-dimethyl-8-propan-2-yl-3,4-dihydro-2H-chromen-4-amine.
What is the SMILES notation for 2,5-dimethyl-8-propan-2-yl-3,4-dihydro-2H-chromen-4-amine?
The canonical SMILES for 2,5-dimethyl-8-propan-2-yl-3,4-dihydro-2H-chromen-4-amine is Cc1ccc(C(C)C)c2c1C(N)CC(C)O2.
What is the InChIKey of 2,5-dimethyl-8-propan-2-yl-3,4-dihydro-2H-chromen-4-amine?
The InChIKey is CMNMCUCHMVFLGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-8(2)11-6-5-9(3)13-12(15)7-10(4)16-14(11)13/h5-6,8,10,12H,7,15H2,1-4H3.
What are the key properties of 2,5-dimethyl-8-propan-2-yl-3,4-dihydro-2H-chromen-4-amine?
2,5-dimethyl-8-propan-2-yl-3,4-dihydro-2H-chromen-4-amine has a molecular weight of 219.33 g/mol, XLogP of 3.29, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-8-propan-2-yl-3,4-dihydro-2H-chromen-4-amine is sourced from PubChem (CID 43537284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).