N-[(1R)-1-[6-(dimethylamino)-2-pyridinyl]ethyl]propanamide

C12H19N3O — CID 175743939

IUPACN-[(1R)-1-[6-(dimethylamino)-2-pyridinyl]ethyl]propanamide
SMILESCCC(=O)N[C@H](C)c1cccc(N(C)C)n1
InChIInChI=1S/C12H19N3O/c1-5-12(16)13-9(2)10-7-6-8-11(14-10)15(3)4/h6-9H,5H2,1-4H3,(H,13,16)/t9-/m1/s1
InChIKeyLTTUZYJESMDFHL-SECBINFHSA-N
MW221.30 g/mol
LogP1.73
Rot. Bonds4

About N-[(1R)-1-[6-(dimethylamino)-2-pyridinyl]ethyl]propanamide

N-[(1R)-1-[6-(dimethylamino)-2-pyridinyl]ethyl]propanamide (PubChem CID 175743939) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N-[(1R)-1-[6-(dimethylamino)-2-pyridinyl]ethyl]propanamide.

Molecular Properties

Compound NameN-[(1R)-1-[6-(dimethylamino)-2-pyridinyl]ethyl]propanamide
PubChem CID175743939
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN-[(1R)-1-[6-(dimethylamino)-2-pyridinyl]ethyl]propanamide
SMILESCCC(=O)N[C@H](C)c1cccc(N(C)C)n1
InChIInChI=1S/C12H19N3O/c1-5-12(16)13-9(2)10-7-6-8-11(14-10)15(3)4/h6-9H,5H2,1-4H3,(H,13,16)/t9-/m1/s1
InChIKeyLTTUZYJESMDFHL-SECBINFHSA-N
XLogP1.73
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-[(1S)-1-[6-(dimethylamino)-2-pyridinyl]-2-hydroxyethyl]propanamide
CID 129077668
N-[(1R)-1-pyridin-2-ylethyl]propanamide
CID 59509331
N-(1-naphthalen-1-ylethyl)propanamide
CID 13202765
6-(dimethylamino)-N-(1-phenylethyl)pyridine-2-carboxamide
CID 84575144
N-[6-(dimethylamino)-2-pyridinyl]-3,3,3-trifluoropropanamide
CID 75519408
N-[6-(propanoylamino)-2-pyridinyl]propanamide
CID 835275
3-[6-(dimethylamino)-2-pyridinyl]-2-methylpropanoic acid
CID 83883833
1-[[6-(dimethylamino)-2-pyridinyl]methyl]-3-(1-hydroxypropan-2-yl)urea
CID 109399230
ethane;N-[1-(6-methyl-2-pyridinyl)ethyl]acetamide
CID 177366227
N-[1-[1-[2-oxo-2-(propan-2-ylamino)ethyl]benzimidazol-2-yl]ethyl]propanamide
CID 17029919
N-[(1S)-1-[1-(2-methylpropyl)benzimidazol-2-yl]ethyl]propanamide
CID 751204
N-[(1S)-1-[6-(ethylamino)-2-pyridinyl]-2-hydroxyethyl]propanamide
CID 129053563

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-[6-(dimethylamino)-2-pyridinyl]ethyl]propanamide?
The IUPAC name of N-[(1R)-1-[6-(dimethylamino)-2-pyridinyl]ethyl]propanamide (CID 175743939) is N-[(1R)-1-[6-(dimethylamino)-2-pyridinyl]ethyl]propanamide.
What is the SMILES notation for N-[(1R)-1-[6-(dimethylamino)-2-pyridinyl]ethyl]propanamide?
The canonical SMILES for N-[(1R)-1-[6-(dimethylamino)-2-pyridinyl]ethyl]propanamide is CCC(=O)N[C@H](C)c1cccc(N(C)C)n1.
What is the InChIKey of N-[(1R)-1-[6-(dimethylamino)-2-pyridinyl]ethyl]propanamide?
The InChIKey is LTTUZYJESMDFHL-SECBINFHSA-N. The full InChI is InChI=1S/C12H19N3O/c1-5-12(16)13-9(2)10-7-6-8-11(14-10)15(3)4/h6-9H,5H2,1-4H3,(H,13,16)/t9-/m1/s1.
What are the key properties of N-[(1R)-1-[6-(dimethylamino)-2-pyridinyl]ethyl]propanamide?
N-[(1R)-1-[6-(dimethylamino)-2-pyridinyl]ethyl]propanamide has a molecular weight of 221.30 g/mol, XLogP of 1.73, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-[6-(dimethylamino)-2-pyridinyl]ethyl]propanamide is sourced from PubChem (CID 175743939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).