N-methyl-N-[(1R)-1-(1,2-oxazol-3-yl)ethyl]-3-pyridin-3-ylpropanamide

C14H17N3O2 — CID 99933009

IUPACN-methyl-N-[(1R)-1-(1,2-oxazol-3-yl)ethyl]-3-pyridin-3-ylpropanamide
SMILESC[C@H](c1ccon1)N(C)C(=O)CCc1cccnc1
InChIInChI=1S/C14H17N3O2/c1-11(13-7-9-19-16-13)17(2)14(18)6-5-12-4-3-8-15-10-12/h3-4,7-11H,5-6H2,1-2H3/t11-/m1/s1
InChIKeyDDGFXRVSKIAZMO-LLVKDONJSA-N
MW259.31 g/mol
LogP2.22
Rot. Bonds5

About N-methyl-N-[(1R)-1-(1,2-oxazol-3-yl)ethyl]-3-pyridin-3-ylpropanamide

N-methyl-N-[(1R)-1-(1,2-oxazol-3-yl)ethyl]-3-pyridin-3-ylpropanamide (PubChem CID 99933009) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-methyl-N-[(1R)-1-(1,2-oxazol-3-yl)ethyl]-3-pyridin-3-ylpropanamide.

Molecular Properties

Compound NameN-methyl-N-[(1R)-1-(1,2-oxazol-3-yl)ethyl]-3-pyridin-3-ylpropanamide
PubChem CID99933009
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-methyl-N-[(1R)-1-(1,2-oxazol-3-yl)ethyl]-3-pyridin-3-ylpropanamide
SMILESC[C@H](c1ccon1)N(C)C(=O)CCc1cccnc1
InChIInChI=1S/C14H17N3O2/c1-11(13-7-9-19-16-13)17(2)14(18)6-5-12-4-3-8-15-10-12/h3-4,7-11H,5-6H2,1-2H3/t11-/m1/s1
InChIKeyDDGFXRVSKIAZMO-LLVKDONJSA-N
XLogP2.22
TPSA59.23 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-3-pyridin-3-yl-N-[(1R)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]propanamide
CID 40717649
N-[2-(dimethylamino)-2-oxoethyl]-N-methyl-3-pyridin-3-ylpropanamide
CID 95903055
N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-3-pyridin-3-ylpropanamide
CID 86912821
2-methyl-4-pyridin-3-ylbutanoic acid
CID 79004008
6-methyl-1-pyridin-3-ylheptane-3,5-dione
CID 159181392
5-methyl-1-pyridin-3-ylheptan-3-one
CID 105091617
2-[2-(dimethylamino)ethyl-(3-pyridin-3-ylpropanoyl)amino]acetic acid
CID 103802557
N-(4-hydroxycyclohexyl)-N-methyl-3-pyridin-3-ylpropanamide
CID 115277440
3-pyridin-3-ylpropanoic acid;hydrochloride
CID 66648902
4-methyl-1-pyridin-3-ylheptan-3-one
CID 107891307
N-(2-hydroxyethyl)-N-propyl-3-pyridin-3-ylpropanamide
CID 60682520
(111C)methyl 3-pyridin-3-ylpropanoate
CID 11816043

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(1R)-1-(1,2-oxazol-3-yl)ethyl]-3-pyridin-3-ylpropanamide?
The IUPAC name of N-methyl-N-[(1R)-1-(1,2-oxazol-3-yl)ethyl]-3-pyridin-3-ylpropanamide (CID 99933009) is N-methyl-N-[(1R)-1-(1,2-oxazol-3-yl)ethyl]-3-pyridin-3-ylpropanamide.
What is the SMILES notation for N-methyl-N-[(1R)-1-(1,2-oxazol-3-yl)ethyl]-3-pyridin-3-ylpropanamide?
The canonical SMILES for N-methyl-N-[(1R)-1-(1,2-oxazol-3-yl)ethyl]-3-pyridin-3-ylpropanamide is C[C@H](c1ccon1)N(C)C(=O)CCc1cccnc1.
What is the InChIKey of N-methyl-N-[(1R)-1-(1,2-oxazol-3-yl)ethyl]-3-pyridin-3-ylpropanamide?
The InChIKey is DDGFXRVSKIAZMO-LLVKDONJSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-11(13-7-9-19-16-13)17(2)14(18)6-5-12-4-3-8-15-10-12/h3-4,7-11H,5-6H2,1-2H3/t11-/m1/s1.
What are the key properties of N-methyl-N-[(1R)-1-(1,2-oxazol-3-yl)ethyl]-3-pyridin-3-ylpropanamide?
N-methyl-N-[(1R)-1-(1,2-oxazol-3-yl)ethyl]-3-pyridin-3-ylpropanamide has a molecular weight of 259.31 g/mol, XLogP of 2.22, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(1R)-1-(1,2-oxazol-3-yl)ethyl]-3-pyridin-3-ylpropanamide is sourced from PubChem (CID 99933009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).