1-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-2-methylbutan-2-ol

C14H24N2O — CID 114495745

IUPAC1-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-2-methylbutan-2-ol
SMILESCCN(Cc1cccc(C)n1)CC(C)(O)CC
InChIInChI=1S/C14H24N2O/c1-5-14(4,17)11-16(6-2)10-13-9-7-8-12(3)15-13/h7-9,17H,5-6,10-11H2,1-4H3
InChIKeyDZMLCSKIPPLAAX-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.37
Rot. Bonds6

About 1-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-2-methylbutan-2-ol

1-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-2-methylbutan-2-ol (PubChem CID 114495745) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 1-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-2-methylbutan-2-ol.

Molecular Properties

Compound Name1-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-2-methylbutan-2-ol
PubChem CID114495745
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name1-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-2-methylbutan-2-ol
SMILESCCN(Cc1cccc(C)n1)CC(C)(O)CC
InChIInChI=1S/C14H24N2O/c1-5-14(4,17)11-16(6-2)10-13-9-7-8-12(3)15-13/h7-9,17H,5-6,10-11H2,1-4H3
InChIKeyDZMLCSKIPPLAAX-UHFFFAOYSA-N
XLogP2.37
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-1-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]propan-2-ol
CID 103935273
N-[(6-chloropyridazin-3-yl)methyl]-N-[(6-methyl-2-pyridinyl)methyl]ethanamine
CID 104513798
[6-[[bis[(6-methyl-2-pyridinyl)methyl]amino]methyl]-2-pyridinyl]methanol
CID 102022866
N,N'-diethyl-N'-[(6-methyl-2-pyridinyl)methyl]ethane-1,2-diamine
CID 79267272
2-[(6-methyl-2-pyridinyl)methyl-propylamino]ethanol
CID 78996621
2-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-2-methylpropanoic acid
CID 79261729
N,N-diethylethanamine;2,6-dimethylpyridine
CID 90016440
N-[(5-bromo-2-pyridinyl)methyl]-N-[(6-methyl-2-pyridinyl)methyl]ethanamine
CID 113254240
1-[3-[[bis[(6-methyl-2-pyridinyl)methyl]amino]methyl]phenyl]-N,N-bis[(6-methyl-2-pyridinyl)methyl]methanamine
CID 11607609
2-[2-(aminomethyl)phenyl]-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]ethanamine
CID 81314059
2-N,2-diethyl-2-N-[(6-methyl-2-pyridinyl)methyl]butane-1,2-diamine
CID 79267944
2-[[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]methyl]-3,3,3-trifluoro-N'-hydroxypropanimidamide
CID 103369996

Frequently Asked Questions

What is the IUPAC name of 1-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-2-methylbutan-2-ol?
The IUPAC name of 1-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-2-methylbutan-2-ol (CID 114495745) is 1-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-2-methylbutan-2-ol.
What is the SMILES notation for 1-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-2-methylbutan-2-ol?
The canonical SMILES for 1-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-2-methylbutan-2-ol is CCN(Cc1cccc(C)n1)CC(C)(O)CC.
What is the InChIKey of 1-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-2-methylbutan-2-ol?
The InChIKey is DZMLCSKIPPLAAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-5-14(4,17)11-16(6-2)10-13-9-7-8-12(3)15-13/h7-9,17H,5-6,10-11H2,1-4H3.
What are the key properties of 1-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-2-methylbutan-2-ol?
1-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-2-methylbutan-2-ol has a molecular weight of 236.36 g/mol, XLogP of 2.37, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-2-methylbutan-2-ol is sourced from PubChem (CID 114495745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).