N'-(1,3-diethyl-6-methyl-2H-pyridin-5-yl)-N,N-dimethylmethanimidamide

C13H23N3 — CID 140968291

IUPACN'-(1,3-diethyl-6-methyl-2H-pyridin-5-yl)-N,N-dimethylmethanimidamide
SMILESCCC1=CC(/N=C/N(C)C)=C(C)N(CC)C1
InChIInChI=1S/C13H23N3/c1-6-12-8-13(14-10-15(4)5)11(3)16(7-2)9-12/h8,10H,6-7,9H2,1-5H3/b14-10+
InChIKeyKAJDCZRQYIRSEN-GXDHUFHOSA-N
MW221.35 g/mol
LogP2.48
Rot. Bonds4

About N'-(1,3-diethyl-6-methyl-2H-pyridin-5-yl)-N,N-dimethylmethanimidamide

N'-(1,3-diethyl-6-methyl-2H-pyridin-5-yl)-N,N-dimethylmethanimidamide (PubChem CID 140968291) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is N'-(1,3-diethyl-6-methyl-2H-pyridin-5-yl)-N,N-dimethylmethanimidamide.

Molecular Properties

Compound NameN'-(1,3-diethyl-6-methyl-2H-pyridin-5-yl)-N,N-dimethylmethanimidamide
PubChem CID140968291
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC NameN'-(1,3-diethyl-6-methyl-2H-pyridin-5-yl)-N,N-dimethylmethanimidamide
SMILESCCC1=CC(/N=C/N(C)C)=C(C)N(CC)C1
InChIInChI=1S/C13H23N3/c1-6-12-8-13(14-10-15(4)5)11(3)16(7-2)9-12/h8,10H,6-7,9H2,1-5H3/b14-10+
InChIKeyKAJDCZRQYIRSEN-GXDHUFHOSA-N
XLogP2.48
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N'-(1,5-diethyl-2H-pyridin-3-yl)-N,N-dimethylmethanimidamide
CID 57037934
N'-(1,5-dimethyl-2H-pyridin-3-yl)-N,N-dimethylmethanimidamide
CID 57257147
3,5,6-triethyl-4H-pyrimidine
CID 129058108
1,5-dimethyl-6-[(6E,7Z)-8-methyl-6-propylidenedeca-4,7-dien-5-yl]-4H-pyrimidine
CID 134526418
3-(cyclohepta-1,3,6-trien-1-ylmethyl)-6-methyl-4H-pyrimidine
CID 135258687
6-Methyl-3-propan-2-yl-3a,4-dihydrobenzimidazole
CID 139297563
ethane;ethene;N'-[(2E,4Z)-hepta-2,4-dien-3-yl]-N-methyl-N-(2-methylidenebut-3-enyl)methanimidamide
CID 143929987
7-Butyl-2-methyl-7,9-diazabicyclo[4.3.1]deca-1,3,6(10),8-tetraene
CID 146594033
N-[6-[(E)-2,3-dimethylbut-1-enyl]-1-ethyl-3,4-dihydro-2H-pyridin-5-yl]methanimine
CID 156481783
5-(2-cyclopropylideneethyl)-6-ethyl-1-methyl-4H-pyrimidine
CID 156519384
(6Z)-1,4,5-trimethyl-6-propylidenepyrimidine
CID 159760374
5-ethyl-6-methyl-3-prop-1-en-2-yl-4H-pyrimidine
CID 163539009

Frequently Asked Questions

What is the IUPAC name of N'-(1,3-diethyl-6-methyl-2H-pyridin-5-yl)-N,N-dimethylmethanimidamide?
The IUPAC name of N'-(1,3-diethyl-6-methyl-2H-pyridin-5-yl)-N,N-dimethylmethanimidamide (CID 140968291) is N'-(1,3-diethyl-6-methyl-2H-pyridin-5-yl)-N,N-dimethylmethanimidamide.
What is the SMILES notation for N'-(1,3-diethyl-6-methyl-2H-pyridin-5-yl)-N,N-dimethylmethanimidamide?
The canonical SMILES for N'-(1,3-diethyl-6-methyl-2H-pyridin-5-yl)-N,N-dimethylmethanimidamide is CCC1=CC(/N=C/N(C)C)=C(C)N(CC)C1.
What is the InChIKey of N'-(1,3-diethyl-6-methyl-2H-pyridin-5-yl)-N,N-dimethylmethanimidamide?
The InChIKey is KAJDCZRQYIRSEN-GXDHUFHOSA-N. The full InChI is InChI=1S/C13H23N3/c1-6-12-8-13(14-10-15(4)5)11(3)16(7-2)9-12/h8,10H,6-7,9H2,1-5H3/b14-10+.
What are the key properties of N'-(1,3-diethyl-6-methyl-2H-pyridin-5-yl)-N,N-dimethylmethanimidamide?
N'-(1,3-diethyl-6-methyl-2H-pyridin-5-yl)-N,N-dimethylmethanimidamide has a molecular weight of 221.35 g/mol, XLogP of 2.48, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1,3-diethyl-6-methyl-2H-pyridin-5-yl)-N,N-dimethylmethanimidamide is sourced from PubChem (CID 140968291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).