[2-[butan-2-yl(methyl)amino]-6-tert-butyl-4-pyridinyl]methanol

C15H26N2O — CID 113380443

IUPAC[2-[butan-2-yl(methyl)amino]-6-tert-butyl-4-pyridinyl]methanol
SMILESCCC(C)N(C)c1cc(CO)cc(C(C)(C)C)n1
InChIInChI=1S/C15H26N2O/c1-7-11(2)17(6)14-9-12(10-18)8-13(16-14)15(3,4)5/h8-9,11,18H,7,10H2,1-6H3
InChIKeyAHWPTCLSIRZYCN-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.11
Rot. Bonds4

About [2-[butan-2-yl(methyl)amino]-6-tert-butyl-4-pyridinyl]methanol

[2-[butan-2-yl(methyl)amino]-6-tert-butyl-4-pyridinyl]methanol (PubChem CID 113380443) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is [2-[butan-2-yl(methyl)amino]-6-tert-butyl-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-[butan-2-yl(methyl)amino]-6-tert-butyl-4-pyridinyl]methanol
PubChem CID113380443
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name[2-[butan-2-yl(methyl)amino]-6-tert-butyl-4-pyridinyl]methanol
SMILESCCC(C)N(C)c1cc(CO)cc(C(C)(C)C)n1
InChIInChI=1S/C15H26N2O/c1-7-11(2)17(6)14-9-12(10-18)8-13(16-14)15(3,4)5/h8-9,11,18H,7,10H2,1-6H3
InChIKeyAHWPTCLSIRZYCN-UHFFFAOYSA-N
XLogP3.11
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(aminomethyl)-6-tert-butyl-N-methyl-N-propan-2-ylpyridin-2-amine
CID 113381296
2-[[6-tert-butyl-4-(hydroxymethyl)-2-pyridinyl]-cyclobutylamino]ethanol
CID 102869293
6-tert-butyl-4-(chloromethyl)-N-methyl-N-(3-methylbutyl)pyridin-2-amine
CID 113380682
[3-[butan-2-yl(methyl)amino]-5-fluorophenyl]methanol
CID 106529697
N-butan-2-yl-4-[(tert-butylamino)methyl]-N-methylpyridin-2-amine
CID 62279317
4-N-butan-2-yl-2-ethyl-4-N,6-N-dimethylpyrimidine-4,6-diamine
CID 80934109
[6-[butan-2-yl(methyl)amino]pyridazin-3-yl]methanol
CID 61255174
2-[[2-tert-butyl-6-(ethylamino)pyrimidin-4-yl]-methylamino]propan-1-ol
CID 104557046
N-butan-2-yl-6-chloro-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 102715484
[2-ethyl-6-[methyl(2,2,2-trifluoroethyl)amino]-4-pyridinyl]methanol
CID 113380475
4-N-butan-2-yl-4-N-methyl-2-methylsulfanylpyrimidine-4,6-diamine
CID 80776688
4-N-butan-2-yl-6-N-ethyl-4-N-methyl-2-methylsulfanylpyrimidine-4,6-diamine
CID 80774336

Frequently Asked Questions

What is the IUPAC name of [2-[butan-2-yl(methyl)amino]-6-tert-butyl-4-pyridinyl]methanol?
The IUPAC name of [2-[butan-2-yl(methyl)amino]-6-tert-butyl-4-pyridinyl]methanol (CID 113380443) is [2-[butan-2-yl(methyl)amino]-6-tert-butyl-4-pyridinyl]methanol.
What is the SMILES notation for [2-[butan-2-yl(methyl)amino]-6-tert-butyl-4-pyridinyl]methanol?
The canonical SMILES for [2-[butan-2-yl(methyl)amino]-6-tert-butyl-4-pyridinyl]methanol is CCC(C)N(C)c1cc(CO)cc(C(C)(C)C)n1.
What is the InChIKey of [2-[butan-2-yl(methyl)amino]-6-tert-butyl-4-pyridinyl]methanol?
The InChIKey is AHWPTCLSIRZYCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-7-11(2)17(6)14-9-12(10-18)8-13(16-14)15(3,4)5/h8-9,11,18H,7,10H2,1-6H3.
What are the key properties of [2-[butan-2-yl(methyl)amino]-6-tert-butyl-4-pyridinyl]methanol?
[2-[butan-2-yl(methyl)amino]-6-tert-butyl-4-pyridinyl]methanol has a molecular weight of 250.39 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[butan-2-yl(methyl)amino]-6-tert-butyl-4-pyridinyl]methanol is sourced from PubChem (CID 113380443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).