(1S)-1-[5-[2-methoxyethyl(propan-2-yl)amino]-2-pyridinyl]propan-1-ol

C14H24N2O2 — CID 103938942

IUPAC(1S)-1-[5-[2-methoxyethyl(propan-2-yl)amino]-2-pyridinyl]propan-1-ol
SMILESCC[C@H](O)c1ccc(N(CCOC)C(C)C)cn1
InChIInChI=1S/C14H24N2O2/c1-5-14(17)13-7-6-12(10-15-13)16(11(2)3)8-9-18-4/h6-7,10-11,14,17H,5,8-9H2,1-4H3/t14-/m0/s1
InChIKeyJPEUHKSOPGVBAX-AWEZNQCLSA-N
MW252.36 g/mol
LogP2.39
Rot. Bonds7

About (1S)-1-[5-[2-methoxyethyl(propan-2-yl)amino]-2-pyridinyl]propan-1-ol

(1S)-1-[5-[2-methoxyethyl(propan-2-yl)amino]-2-pyridinyl]propan-1-ol (PubChem CID 103938942) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is (1S)-1-[5-[2-methoxyethyl(propan-2-yl)amino]-2-pyridinyl]propan-1-ol.

Molecular Properties

Compound Name(1S)-1-[5-[2-methoxyethyl(propan-2-yl)amino]-2-pyridinyl]propan-1-ol
PubChem CID103938942
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name(1S)-1-[5-[2-methoxyethyl(propan-2-yl)amino]-2-pyridinyl]propan-1-ol
SMILESCC[C@H](O)c1ccc(N(CCOC)C(C)C)cn1
InChIInChI=1S/C14H24N2O2/c1-5-14(17)13-7-6-12(10-15-13)16(11(2)3)8-9-18-4/h6-7,10-11,14,17H,5,8-9H2,1-4H3/t14-/m0/s1
InChIKeyJPEUHKSOPGVBAX-AWEZNQCLSA-N
XLogP2.39
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1S)-1-[5-[propan-2-yl(propyl)amino]-2-pyridinyl]propan-1-ol
CID 103938356
(1R)-1-[5-[1-cyclopropylethyl(2-methoxyethyl)amino]-2-pyridinyl]propan-1-ol
CID 103938600
(1S)-1-[5-[2-methoxyethyl(2-methylpropyl)amino]-2-pyridinyl]propan-1-ol
CID 103938533
N-(2-methoxyethyl)-6-[1-(methylamino)ethyl]-N-propan-2-ylpyridin-3-amine
CID 83128056
1-[5-[pentyl(propan-2-yl)amino]-2-pyridinyl]propan-1-ol
CID 112585369
1-[4-[2-methoxyethyl(propan-2-yl)amino]phenyl]propan-1-ol
CID 114066905
6-(1-aminoethyl)-N-butan-2-yl-N-(2-methoxyethyl)pyridin-3-amine
CID 83122259
N-(2-methoxyethyl)-6-[1-(methylamino)ethyl]-N-pentan-3-ylpyridin-3-amine
CID 83122101
(1R)-1-[4-[2-methoxyethyl(propan-2-yl)amino]phenyl]ethanol
CID 82951638
1-[5-[methyl(propyl)amino]-2-pyridinyl]propan-1-ol
CID 112585264
(1S)-1-[2-[2-methoxyethyl(propan-2-yl)amino]phenyl]propan-1-ol
CID 103960325
5-[butan-2-yl(2-methoxyethyl)amino]pyridine-2-carboximidamide
CID 115489592

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[5-[2-methoxyethyl(propan-2-yl)amino]-2-pyridinyl]propan-1-ol?
The IUPAC name of (1S)-1-[5-[2-methoxyethyl(propan-2-yl)amino]-2-pyridinyl]propan-1-ol (CID 103938942) is (1S)-1-[5-[2-methoxyethyl(propan-2-yl)amino]-2-pyridinyl]propan-1-ol.
What is the SMILES notation for (1S)-1-[5-[2-methoxyethyl(propan-2-yl)amino]-2-pyridinyl]propan-1-ol?
The canonical SMILES for (1S)-1-[5-[2-methoxyethyl(propan-2-yl)amino]-2-pyridinyl]propan-1-ol is CC[C@H](O)c1ccc(N(CCOC)C(C)C)cn1.
What is the InChIKey of (1S)-1-[5-[2-methoxyethyl(propan-2-yl)amino]-2-pyridinyl]propan-1-ol?
The InChIKey is JPEUHKSOPGVBAX-AWEZNQCLSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-5-14(17)13-7-6-12(10-15-13)16(11(2)3)8-9-18-4/h6-7,10-11,14,17H,5,8-9H2,1-4H3/t14-/m0/s1.
What are the key properties of (1S)-1-[5-[2-methoxyethyl(propan-2-yl)amino]-2-pyridinyl]propan-1-ol?
(1S)-1-[5-[2-methoxyethyl(propan-2-yl)amino]-2-pyridinyl]propan-1-ol has a molecular weight of 252.36 g/mol, XLogP of 2.39, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[5-[2-methoxyethyl(propan-2-yl)amino]-2-pyridinyl]propan-1-ol is sourced from PubChem (CID 103938942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).