(1R)-1-[5-[ethyl(2-methylbutyl)amino]-2-pyridinyl]ethanol

C14H24N2O — CID 83132263

IUPAC(1R)-1-[5-[ethyl(2-methylbutyl)amino]-2-pyridinyl]ethanol
SMILESCCC(C)CN(CC)c1ccc([C@@H](C)O)nc1
InChIInChI=1S/C14H24N2O/c1-5-11(3)10-16(6-2)13-7-8-14(12(4)17)15-9-13/h7-9,11-12,17H,5-6,10H2,1-4H3/t11?,12-/m1/s1
InChIKeyMSSOFDNGZIQVQK-PIJUOVFKSA-N
MW236.36 g/mol
LogP3.01
Rot. Bonds6

About (1R)-1-[5-[ethyl(2-methylbutyl)amino]-2-pyridinyl]ethanol

(1R)-1-[5-[ethyl(2-methylbutyl)amino]-2-pyridinyl]ethanol (PubChem CID 83132263) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is (1R)-1-[5-[ethyl(2-methylbutyl)amino]-2-pyridinyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[5-[ethyl(2-methylbutyl)amino]-2-pyridinyl]ethanol
PubChem CID83132263
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name(1R)-1-[5-[ethyl(2-methylbutyl)amino]-2-pyridinyl]ethanol
SMILESCCC(C)CN(CC)c1ccc([C@@H](C)O)nc1
InChIInChI=1S/C14H24N2O/c1-5-11(3)10-16(6-2)13-7-8-14(12(4)17)15-9-13/h7-9,11-12,17H,5-6,10H2,1-4H3/t11?,12-/m1/s1
InChIKeyMSSOFDNGZIQVQK-PIJUOVFKSA-N
XLogP3.01
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 ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-[5-[ethyl(2-methylprop-2-enyl)amino]-2-pyridinyl]ethanol
CID 83131507
(1R)-1-[5-[ethyl(2-methylpropyl)amino]-2-pyridinyl]propan-1-ol
CID 113355284
(1S)-1-[5-[butan-2-yl(ethyl)amino]-2-pyridinyl]ethanol
CID 83132626
1-[5-[2-ethoxyethyl(ethyl)amino]-2-pyridinyl]ethanol
CID 83132254
N-ethyl-2-[ethyl-[6-(1-hydroxyethyl)-3-pyridinyl]amino]acetamide
CID 83132139
(1R)-1-[5-[ethyl(pyridin-2-ylmethyl)amino]-2-pyridinyl]ethanol
CID 83132096
1-[5-[1-(dimethylamino)propan-2-yl-ethylamino]-2-pyridinyl]ethanol
CID 103189789
1-[5-[2-methylpropyl(pentan-3-yl)amino]-2-pyridinyl]ethanol
CID 83131569
(1S)-1-[5-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-2-pyridinyl]ethanol
CID 83131657
2-[cyanomethyl-[6-(1-hydroxyethyl)-3-pyridinyl]amino]acetonitrile
CID 83132280
(1S)-1-[5-[2-(dimethylamino)ethyl-propylamino]-2-pyridinyl]ethanol
CID 83132568
(1S)-1-[5-[bis(cyclopropylmethyl)amino]-2-pyridinyl]ethanol
CID 83132171

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[5-[ethyl(2-methylbutyl)amino]-2-pyridinyl]ethanol?
The IUPAC name of (1R)-1-[5-[ethyl(2-methylbutyl)amino]-2-pyridinyl]ethanol (CID 83132263) is (1R)-1-[5-[ethyl(2-methylbutyl)amino]-2-pyridinyl]ethanol.
What is the SMILES notation for (1R)-1-[5-[ethyl(2-methylbutyl)amino]-2-pyridinyl]ethanol?
The canonical SMILES for (1R)-1-[5-[ethyl(2-methylbutyl)amino]-2-pyridinyl]ethanol is CCC(C)CN(CC)c1ccc([C@@H](C)O)nc1.
What is the InChIKey of (1R)-1-[5-[ethyl(2-methylbutyl)amino]-2-pyridinyl]ethanol?
The InChIKey is MSSOFDNGZIQVQK-PIJUOVFKSA-N. The full InChI is InChI=1S/C14H24N2O/c1-5-11(3)10-16(6-2)13-7-8-14(12(4)17)15-9-13/h7-9,11-12,17H,5-6,10H2,1-4H3/t11?,12-/m1/s1.
What are the key properties of (1R)-1-[5-[ethyl(2-methylbutyl)amino]-2-pyridinyl]ethanol?
(1R)-1-[5-[ethyl(2-methylbutyl)amino]-2-pyridinyl]ethanol has a molecular weight of 236.36 g/mol, XLogP of 3.01, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[5-[ethyl(2-methylbutyl)amino]-2-pyridinyl]ethanol is sourced from PubChem (CID 83132263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).