2,5,7,8-tetramethyl-2-[(pyridin-4-ylamino)methyl]-3,4-dihydrochromen-6-ol

C19H24N2O2 — CID 10380818

IUPAC2,5,7,8-tetramethyl-2-[(pyridin-4-ylamino)methyl]-3,4-dihydrochromen-6-ol
SMILESCc1c(C)c2c(c(C)c1O)CCC(C)(CNc1ccncc1)O2
InChIInChI=1S/C19H24N2O2/c1-12-13(2)18-16(14(3)17(12)22)5-8-19(4,23-18)11-21-15-6-9-20-10-7-15/h6-7,9-10,22H,5,8,11H2,1-4H3,(H,20,21)
InChIKeyMUBFRCIIZQBVMC-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.91
Rot. Bonds3

About 2,5,7,8-tetramethyl-2-[(pyridin-4-ylamino)methyl]-3,4-dihydrochromen-6-ol

2,5,7,8-tetramethyl-2-[(pyridin-4-ylamino)methyl]-3,4-dihydrochromen-6-ol (PubChem CID 10380818) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 2,5,7,8-tetramethyl-2-[(pyridin-4-ylamino)methyl]-3,4-dihydrochromen-6-ol.

Molecular Properties

Compound Name2,5,7,8-tetramethyl-2-[(pyridin-4-ylamino)methyl]-3,4-dihydrochromen-6-ol
PubChem CID10380818
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name2,5,7,8-tetramethyl-2-[(pyridin-4-ylamino)methyl]-3,4-dihydrochromen-6-ol
SMILESCc1c(C)c2c(c(C)c1O)CCC(C)(CNc1ccncc1)O2
InChIInChI=1S/C19H24N2O2/c1-12-13(2)18-16(14(3)17(12)22)5-8-19(4,23-18)11-21-15-6-9-20-10-7-15/h6-7,9-10,22H,5,8,11H2,1-4H3,(H,20,21)
InChIKeyMUBFRCIIZQBVMC-UHFFFAOYSA-N
XLogP3.91
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2,5,7,8-tetramethyl-2-[(pyridin-4-ylamino)methyl]-3,4-dihydrochromen-6-ol 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

2,5,7,8-tetramethyl-2-[(1,3-thiazol-2-ylamino)methyl]-3,4-dihydrochromen-6-ol
CID 19024015
(2R)-2,5,7,8-tetramethyl-2-[9-(triazol-2-yl)nonyl]-3,4-dihydrochromen-6-ol
CID 25119045
2,5,7,8-tetramethyl-2-(5-methylhexyl)-3,4-dihydrochromen-6-ol
CID 58280984
(2R)-2,5,7,8-tetramethyl-2-(12-methyltridecyl)-3,4-dihydrochromen-6-ol
CID 147729867
10-(6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl)decyl-triphenylphosphanium
CID 132554822
1-(6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl)-2,2-dimethylpropan-1-one
CID 72523898
2,5,7,8-tetramethyl-2-[2-(4-phenylpiperidin-1-yl)ethyl]-3,4-dihydrochromen-6-ol
CID 139676968
(6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl)methyl 4-methoxybenzoate
CID 146681010
2-[2-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]ethyl]-2,5,7,8-tetramethyl-3,4-dihydrochromen-6-ol
CID 139676959
2-[(N-butylanilino)methyl]-2,5,7,8-tetramethyl-3,4-dihydrochromen-6-ol
CID 19024077
2-(4,8-dimethyldodecyl)-2,5,7,8-tetramethyl-3,4-dihydrochromen-6-ol
CID 20758468
(2S)-2,5,7,8-tetramethyl-2-[(4R,8S)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-ol;hydrochloride
CID 141451505

Frequently Asked Questions

What is the IUPAC name of 2,5,7,8-tetramethyl-2-[(pyridin-4-ylamino)methyl]-3,4-dihydrochromen-6-ol?
The IUPAC name of 2,5,7,8-tetramethyl-2-[(pyridin-4-ylamino)methyl]-3,4-dihydrochromen-6-ol (CID 10380818) is 2,5,7,8-tetramethyl-2-[(pyridin-4-ylamino)methyl]-3,4-dihydrochromen-6-ol.
What is the SMILES notation for 2,5,7,8-tetramethyl-2-[(pyridin-4-ylamino)methyl]-3,4-dihydrochromen-6-ol?
The canonical SMILES for 2,5,7,8-tetramethyl-2-[(pyridin-4-ylamino)methyl]-3,4-dihydrochromen-6-ol is Cc1c(C)c2c(c(C)c1O)CCC(C)(CNc1ccncc1)O2.
What is the InChIKey of 2,5,7,8-tetramethyl-2-[(pyridin-4-ylamino)methyl]-3,4-dihydrochromen-6-ol?
The InChIKey is MUBFRCIIZQBVMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-12-13(2)18-16(14(3)17(12)22)5-8-19(4,23-18)11-21-15-6-9-20-10-7-15/h6-7,9-10,22H,5,8,11H2,1-4H3,(H,20,21).
What are the key properties of 2,5,7,8-tetramethyl-2-[(pyridin-4-ylamino)methyl]-3,4-dihydrochromen-6-ol?
2,5,7,8-tetramethyl-2-[(pyridin-4-ylamino)methyl]-3,4-dihydrochromen-6-ol has a molecular weight of 312.41 g/mol, XLogP of 3.91, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5,7,8-tetramethyl-2-[(pyridin-4-ylamino)methyl]-3,4-dihydrochromen-6-ol is sourced from PubChem (CID 10380818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).