N,N-dimethyl-2-[methyl-[[(5Z)-6-methylidene-5-(2-methylprop-2-enylidene)-2-oxo-3-pyridinyl]methyl]amino]propanamide

C17H25N3O2 — CID 155181721

IUPACN,N-dimethyl-2-[methyl-[[(5Z)-6-methylidene-5-(2-methylprop-2-enylidene)-2-oxo-3-pyridinyl]methyl]amino]propanamide
SMILESC=C(C)/C=c1/cc(CN(C)C(C)C(=O)N(C)C)c(=O)[nH]c1=C
InChIInChI=1S/C17H25N3O2/c1-11(2)8-14-9-15(16(21)18-12(14)3)10-20(7)13(4)17(22)19(5)6/h8-9,13H,1,3,10H2,2,4-7H3,(H,18,21)/b14-8-
InChIKeyNYVWKHDSGLBSSF-ZSOIEALJSA-N
MW303.41 g/mol
LogP0.05
Rot. Bonds5

About N,N-dimethyl-2-[methyl-[[(5Z)-6-methylidene-5-(2-methylprop-2-enylidene)-2-oxo-3-pyridinyl]methyl]amino]propanamide

N,N-dimethyl-2-[methyl-[[(5Z)-6-methylidene-5-(2-methylprop-2-enylidene)-2-oxo-3-pyridinyl]methyl]amino]propanamide (PubChem CID 155181721) has the molecular formula C17H25N3O2 and a molecular weight of 303.41 g/mol. Its IUPAC name is N,N-dimethyl-2-[methyl-[[(5Z)-6-methylidene-5-(2-methylprop-2-enylidene)-2-oxo-3-pyridinyl]methyl]amino]propanamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[methyl-[[(5Z)-6-methylidene-5-(2-methylprop-2-enylidene)-2-oxo-3-pyridinyl]methyl]amino]propanamide
PubChem CID155181721
Molecular FormulaC17H25N3O2
Molecular Weight303.41 g/mol
Exact Mass303.19
IUPAC NameN,N-dimethyl-2-[methyl-[[(5Z)-6-methylidene-5-(2-methylprop-2-enylidene)-2-oxo-3-pyridinyl]methyl]amino]propanamide
SMILESC=C(C)/C=c1/cc(CN(C)C(C)C(=O)N(C)C)c(=O)[nH]c1=C
InChIInChI=1S/C17H25N3O2/c1-11(2)8-14-9-15(16(21)18-12(14)3)10-20(7)13(4)17(22)19(5)6/h8-9,13H,1,3,10H2,2,4-7H3,(H,18,21)/b14-8-
InChIKeyNYVWKHDSGLBSSF-ZSOIEALJSA-N
XLogP0.05
TPSA56.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[methyl-[[(5Z)-6-methylidene-5-(2-methylprop-2-enylidene)-2-oxo-3-pyridinyl]methyl]amino]propanamide?
The IUPAC name of N,N-dimethyl-2-[methyl-[[(5Z)-6-methylidene-5-(2-methylprop-2-enylidene)-2-oxo-3-pyridinyl]methyl]amino]propanamide (CID 155181721) is N,N-dimethyl-2-[methyl-[[(5Z)-6-methylidene-5-(2-methylprop-2-enylidene)-2-oxo-3-pyridinyl]methyl]amino]propanamide.
What is the SMILES notation for N,N-dimethyl-2-[methyl-[[(5Z)-6-methylidene-5-(2-methylprop-2-enylidene)-2-oxo-3-pyridinyl]methyl]amino]propanamide?
The canonical SMILES for N,N-dimethyl-2-[methyl-[[(5Z)-6-methylidene-5-(2-methylprop-2-enylidene)-2-oxo-3-pyridinyl]methyl]amino]propanamide is C=C(C)/C=c1/cc(CN(C)C(C)C(=O)N(C)C)c(=O)[nH]c1=C.
What is the InChIKey of N,N-dimethyl-2-[methyl-[[(5Z)-6-methylidene-5-(2-methylprop-2-enylidene)-2-oxo-3-pyridinyl]methyl]amino]propanamide?
The InChIKey is NYVWKHDSGLBSSF-ZSOIEALJSA-N. The full InChI is InChI=1S/C17H25N3O2/c1-11(2)8-14-9-15(16(21)18-12(14)3)10-20(7)13(4)17(22)19(5)6/h8-9,13H,1,3,10H2,2,4-7H3,(H,18,21)/b14-8-.
What are the key properties of N,N-dimethyl-2-[methyl-[[(5Z)-6-methylidene-5-(2-methylprop-2-enylidene)-2-oxo-3-pyridinyl]methyl]amino]propanamide?
N,N-dimethyl-2-[methyl-[[(5Z)-6-methylidene-5-(2-methylprop-2-enylidene)-2-oxo-3-pyridinyl]methyl]amino]propanamide has a molecular weight of 303.41 g/mol, XLogP of 0.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[methyl-[[(5Z)-6-methylidene-5-(2-methylprop-2-enylidene)-2-oxo-3-pyridinyl]methyl]amino]propanamide is sourced from PubChem (CID 155181721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).