2-ethyl-N,2-dimethyl-3,4-dihydrochromen-4-amine

C13H19NO — CID 82462113

IUPAC2-ethyl-N,2-dimethyl-3,4-dihydrochromen-4-amine
SMILESCCC1(C)CC(NC)c2ccccc2O1
InChIInChI=1S/C13H19NO/c1-4-13(2)9-11(14-3)10-7-5-6-8-12(10)15-13/h5-8,11,14H,4,9H2,1-3H3
InChIKeyODVATIKXJRWESB-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.90
Rot. Bonds2

About 2-ethyl-N,2-dimethyl-3,4-dihydrochromen-4-amine

2-ethyl-N,2-dimethyl-3,4-dihydrochromen-4-amine (PubChem CID 82462113) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 2-ethyl-N,2-dimethyl-3,4-dihydrochromen-4-amine.

Molecular Properties

Compound Name2-ethyl-N,2-dimethyl-3,4-dihydrochromen-4-amine
PubChem CID82462113
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name2-ethyl-N,2-dimethyl-3,4-dihydrochromen-4-amine
SMILESCCC1(C)CC(NC)c2ccccc2O1
InChIInChI=1S/C13H19NO/c1-4-13(2)9-11(14-3)10-7-5-6-8-12(10)15-13/h5-8,11,14H,4,9H2,1-3H3
InChIKeyODVATIKXJRWESB-UHFFFAOYSA-N
XLogP2.90
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,2-dimethyl-2-(2-phenylethyl)-3,4-dihydrochromen-4-amine
CID 114712083
2-ethyl-2-methyl-N-pentyl-3,4-dihydrochromen-4-amine
CID 82462123
(4S)-2-ethyl-2-methyl-3,4-dihydrochromen-4-amine
CID 104945969
N-(2-ethyl-2-methyl-3,4-dihydrochromen-4-yl)-N',N'-dimethylpropane-1,3-diamine
CID 82462120
N,2-dimethyl-2-(1-methylcyclopropyl)-3,4-dihydrochromen-4-amine
CID 114711989
2-(cyclopropylmethyl)-N-ethyl-2-methyl-3,4-dihydrochromen-4-amine
CID 114712262
N,3',5'-trimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-amine
CID 114711957
2-(cyclobutylmethyl)-N-ethyl-2-methyl-3,4-dihydrochromen-4-amine
CID 114712231
2-(cyclopropylmethyl)-2-methyl-N-propyl-3,4-dihydrochromen-4-amine
CID 114712415
N-methyl-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
CID 114711983
N-(2,2-diethyl-3,4-dihydrochromen-4-yl)propanamide
CID 133160348
N,3,3-trimethyl-2,4-dihydro-1H-naphthalen-1-amine
CID 84618813

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N,2-dimethyl-3,4-dihydrochromen-4-amine?
The IUPAC name of 2-ethyl-N,2-dimethyl-3,4-dihydrochromen-4-amine (CID 82462113) is 2-ethyl-N,2-dimethyl-3,4-dihydrochromen-4-amine.
What is the SMILES notation for 2-ethyl-N,2-dimethyl-3,4-dihydrochromen-4-amine?
The canonical SMILES for 2-ethyl-N,2-dimethyl-3,4-dihydrochromen-4-amine is CCC1(C)CC(NC)c2ccccc2O1.
What is the InChIKey of 2-ethyl-N,2-dimethyl-3,4-dihydrochromen-4-amine?
The InChIKey is ODVATIKXJRWESB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-4-13(2)9-11(14-3)10-7-5-6-8-12(10)15-13/h5-8,11,14H,4,9H2,1-3H3.
What are the key properties of 2-ethyl-N,2-dimethyl-3,4-dihydrochromen-4-amine?
2-ethyl-N,2-dimethyl-3,4-dihydrochromen-4-amine has a molecular weight of 205.30 g/mol, XLogP of 2.90, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N,2-dimethyl-3,4-dihydrochromen-4-amine is sourced from PubChem (CID 82462113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).