2-[[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-propylamino]-N,N-dimethylacetamide

C14H23N3O2 — CID 83131620

IUPAC2-[[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-propylamino]-N,N-dimethylacetamide
SMILESCCCN(CC(=O)N(C)C)c1ccc([C@@H](C)O)nc1
InChIInChI=1S/C14H23N3O2/c1-5-8-17(10-14(19)16(3)4)12-6-7-13(11(2)18)15-9-12/h6-7,9,11,18H,5,8,10H2,1-4H3/t11-/m1/s1
InChIKeyNYDOWCZDWZQINM-LLVKDONJSA-N
MW265.36 g/mol
LogP1.44
Rot. Bonds6

About 2-[[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-propylamino]-N,N-dimethylacetamide

2-[[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-propylamino]-N,N-dimethylacetamide (PubChem CID 83131620) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-[[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-propylamino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-propylamino]-N,N-dimethylacetamide
PubChem CID83131620
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name2-[[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-propylamino]-N,N-dimethylacetamide
SMILESCCCN(CC(=O)N(C)C)c1ccc([C@@H](C)O)nc1
InChIInChI=1S/C14H23N3O2/c1-5-8-17(10-14(19)16(3)4)12-6-7-13(11(2)18)15-9-12/h6-7,9,11,18H,5,8,10H2,1-4H3/t11-/m1/s1
InChIKeyNYDOWCZDWZQINM-LLVKDONJSA-N
XLogP1.44
TPSA56.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-propylamino]-N,N-dimethylacetamide?
The IUPAC name of 2-[[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-propylamino]-N,N-dimethylacetamide (CID 83131620) is 2-[[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-propylamino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-propylamino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-propylamino]-N,N-dimethylacetamide is CCCN(CC(=O)N(C)C)c1ccc([C@@H](C)O)nc1.
What is the InChIKey of 2-[[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-propylamino]-N,N-dimethylacetamide?
The InChIKey is NYDOWCZDWZQINM-LLVKDONJSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-5-8-17(10-14(19)16(3)4)12-6-7-13(11(2)18)15-9-12/h6-7,9,11,18H,5,8,10H2,1-4H3/t11-/m1/s1.
What are the key properties of 2-[[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-propylamino]-N,N-dimethylacetamide?
2-[[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-propylamino]-N,N-dimethylacetamide has a molecular weight of 265.36 g/mol, XLogP of 1.44, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-propylamino]-N,N-dimethylacetamide is sourced from PubChem (CID 83131620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).