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

C8H15N3 — CID 166075890

IUPACN',2-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide
SMILESC/N=C(\N)C1=CCNC(C)C1
InChIInChI=1S/C8H15N3/c1-6-5-7(3-4-11-6)8(9)10-2/h3,6,11H,4-5H2,1-2H3,(H2,9,10)
InChIKeyVAZCTTFOGCXXCY-UHFFFAOYSA-N
MW153.23 g/mol
LogP0.28
Rot. Bonds1

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

N',2-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide (PubChem CID 166075890) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is N',2-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide.

Molecular Properties

Compound NameN',2-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide
PubChem CID166075890
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC NameN',2-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide
SMILESC/N=C(\N)C1=CCNC(C)C1
InChIInChI=1S/C8H15N3/c1-6-5-7(3-4-11-6)8(9)10-2/h3,6,11H,4-5H2,1-2H3,(H2,9,10)
InChIKeyVAZCTTFOGCXXCY-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

1,2,3,5,6,7-Hexahydro-1,8-naphthyridine
CID 89343384
6-methyl-3,5,6,7-tetrahydro-2H-pyrrolo[2,3-b]pyridine
CID 91085484
(2Z)-3,4-diamino-N'-methyl-2-(4-methylidenepiperidin-3-ylidene)pentanimidamide
CID 122468376
6-methyl-4,5,6,7-tetrahydro-2H-pyrrolo[2,3-b]pyridine
CID 123158436
N-(4-aminocyclohexyl)-N',3-dimethyl-2-methylidenepent-3-enimidamide
CID 123545213
2,4-Dimethyl-1,2,6,7-tetrahydro-1,8-naphthyridine
CID 123586881
N'-butyl-6-methyl-N-propan-2-ylcyclohexa-1,3-diene-1-carboximidamide
CID 124013843
3-but-1-en-2-yl-N-propan-2-yl-5,6-dihydro-2H-azepin-7-amine
CID 129082407
N',2-dimethyl-N-propan-2-ylcyclohexa-1,5-diene-1-carboximidamide
CID 130220199
2,11-Diazabicyclo[5.4.0]undeca-1,7-dien-3-yne
CID 136640509
4-(Ethylamino)cyclohexa-1,3-diene-1-carboximidamide
CID 137002113
(5Z)-5-propylidene-3,4-dihydro-2H-pyridin-6-amine
CID 139453375

Frequently Asked Questions

What is the IUPAC name of N',2-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide?
The IUPAC name of N',2-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide (CID 166075890) is N',2-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide.
What is the SMILES notation for N',2-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide?
The canonical SMILES for N',2-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide is C/N=C(\N)C1=CCNC(C)C1.
What is the InChIKey of N',2-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide?
The InChIKey is VAZCTTFOGCXXCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-6-5-7(3-4-11-6)8(9)10-2/h3,6,11H,4-5H2,1-2H3,(H2,9,10).
What are the key properties of N',2-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide?
N',2-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',2-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide is sourced from PubChem (CID 166075890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).