N'-[5-[1-(dimethylamino)ethenyl]-2,6-dimethyl-3-pyridinyl]-N-ethyl-N-methylmethanimidamide

C15H24N4 — CID 145294582

IUPACN'-[5-[1-(dimethylamino)ethenyl]-2,6-dimethyl-3-pyridinyl]-N-ethyl-N-methylmethanimidamide
SMILESC=C(c1cc(/N=C/N(C)CC)c(C)nc1C)N(C)C
InChIInChI=1S/C15H24N4/c1-8-19(7)10-16-15-9-14(13(4)18(5)6)11(2)17-12(15)3/h9-10H,4,8H2,1-3,5-7H3/b16-10+
InChIKeyXJDRDUYGZWUKBA-MHWRWJLKSA-N
MW260.38 g/mol
LogP2.84
Rot. Bonds5

About N'-[5-[1-(dimethylamino)ethenyl]-2,6-dimethyl-3-pyridinyl]-N-ethyl-N-methylmethanimidamide

N'-[5-[1-(dimethylamino)ethenyl]-2,6-dimethyl-3-pyridinyl]-N-ethyl-N-methylmethanimidamide (PubChem CID 145294582) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is N'-[5-[1-(dimethylamino)ethenyl]-2,6-dimethyl-3-pyridinyl]-N-ethyl-N-methylmethanimidamide.

Molecular Properties

Compound NameN'-[5-[1-(dimethylamino)ethenyl]-2,6-dimethyl-3-pyridinyl]-N-ethyl-N-methylmethanimidamide
PubChem CID145294582
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC NameN'-[5-[1-(dimethylamino)ethenyl]-2,6-dimethyl-3-pyridinyl]-N-ethyl-N-methylmethanimidamide
SMILESC=C(c1cc(/N=C/N(C)CC)c(C)nc1C)N(C)C
InChIInChI=1S/C15H24N4/c1-8-19(7)10-16-15-9-14(13(4)18(5)6)11(2)17-12(15)3/h9-10H,4,8H2,1-3,5-7H3/b16-10+
InChIKeyXJDRDUYGZWUKBA-MHWRWJLKSA-N
XLogP2.84
TPSA31.73 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-[5-[1-(dimethylamino)ethenyl]-2,6-dimethyl-3-pyridinyl]-N-ethyl-N-methylmethanimidamide?
The IUPAC name of N'-[5-[1-(dimethylamino)ethenyl]-2,6-dimethyl-3-pyridinyl]-N-ethyl-N-methylmethanimidamide (CID 145294582) is N'-[5-[1-(dimethylamino)ethenyl]-2,6-dimethyl-3-pyridinyl]-N-ethyl-N-methylmethanimidamide.
What is the SMILES notation for N'-[5-[1-(dimethylamino)ethenyl]-2,6-dimethyl-3-pyridinyl]-N-ethyl-N-methylmethanimidamide?
The canonical SMILES for N'-[5-[1-(dimethylamino)ethenyl]-2,6-dimethyl-3-pyridinyl]-N-ethyl-N-methylmethanimidamide is C=C(c1cc(/N=C/N(C)CC)c(C)nc1C)N(C)C.
What is the InChIKey of N'-[5-[1-(dimethylamino)ethenyl]-2,6-dimethyl-3-pyridinyl]-N-ethyl-N-methylmethanimidamide?
The InChIKey is XJDRDUYGZWUKBA-MHWRWJLKSA-N. The full InChI is InChI=1S/C15H24N4/c1-8-19(7)10-16-15-9-14(13(4)18(5)6)11(2)17-12(15)3/h9-10H,4,8H2,1-3,5-7H3/b16-10+.
What are the key properties of N'-[5-[1-(dimethylamino)ethenyl]-2,6-dimethyl-3-pyridinyl]-N-ethyl-N-methylmethanimidamide?
N'-[5-[1-(dimethylamino)ethenyl]-2,6-dimethyl-3-pyridinyl]-N-ethyl-N-methylmethanimidamide has a molecular weight of 260.38 g/mol, XLogP of 2.84, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[5-[1-(dimethylamino)ethenyl]-2,6-dimethyl-3-pyridinyl]-N-ethyl-N-methylmethanimidamide is sourced from PubChem (CID 145294582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).