N',6-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide

C8H15N3 — CID 166075917

IUPACN',6-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide
SMILESC/N=C(\N)C1=CC(C)NCC1
InChIInChI=1S/C8H15N3/c1-6-5-7(3-4-11-6)8(9)10-2/h5-6,11H,3-4H2,1-2H3,(H2,9,10)
InChIKeyMHZXWIBBAKHVNI-UHFFFAOYSA-N
MW153.23 g/mol
LogP0.28
Rot. Bonds1

About N',6-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide

N',6-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide (PubChem CID 166075917) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is N',6-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide.

Molecular Properties

Compound NameN',6-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide
PubChem CID166075917
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC NameN',6-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide
SMILESC/N=C(\N)C1=CC(C)NCC1
InChIInChI=1S/C8H15N3/c1-6-5-7(3-4-11-6)8(9)10-2/h5-6,11H,3-4H2,1-2H3,(H2,9,10)
InChIKeyMHZXWIBBAKHVNI-UHFFFAOYSA-N
XLogP0.28
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 50.28
H-Bond Donors ≤ 52
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

1,1,1-trifluoro-4-N-(5-methyl-2,3-dihydropyridin-6-yl)pentane-2,4-diamine
CID 148873990
N-propan-2-yl-2,5-dihydropyridin-6-amine
CID 56637934
(Z)-N'-(3-aminobutan-2-yl)-2-ethylbut-2-enimidamide
CID 90944521
6-methyl-3,5,6,7-tetrahydro-2H-pyrrolo[2,3-b]pyridine
CID 91085484
5-Methyl-2,3-dihydropyridine-3,6-diamine
CID 91145889
4-(1-But-2-ynyl-4-methyl-4,5-dihydroimidazol-2-yl)-1,2,3,6-tetrahydropyridine
CID 91582959
N-(2,6-dimethylhepta-2,5-dien-4-yl)-3,4-dihydro-2H-pyrrol-5-amine
CID 121451327
2,4-Dimethyl-1,2,6,7-tetrahydro-1,8-naphthyridine
CID 123586881
5-ethenyl-N-methyl-2,3-dihydro-1H-pyridin-6-imine
CID 136489670
2-N,6-N-dibutyl-5-ethyl-3H-pyridine-2,6-diimine
CID 137053045
3-[(6R)-6-methyl-1,2,3,6-tetrahydropyridin-4-yl]-2H-1,2,4-oxadiazole-5-thione
CID 141175216
3-[(6R)-6-methyl-1,2,3,6-tetrahydropyridin-4-yl]-2H-1,2,4-thiadiazole-5-thione
CID 141175220

Frequently Asked Questions

What is the IUPAC name of N',6-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide?
The IUPAC name of N',6-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide (CID 166075917) is N',6-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide.
What is the SMILES notation for N',6-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide?
The canonical SMILES for N',6-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide is C/N=C(\N)C1=CC(C)NCC1.
What is the InChIKey of N',6-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide?
The InChIKey is MHZXWIBBAKHVNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-6-5-7(3-4-11-6)8(9)10-2/h5-6,11H,3-4H2,1-2H3,(H2,9,10).
What are the key properties of N',6-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide?
N',6-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide has a molecular weight of 153.23 g/mol, XLogP of 0.28, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N',6-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide is sourced from PubChem (CID 166075917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).