N-(3-methylbut-2-enyl)-2,3,4,5-tetrahydropyridin-6-amine

C10H18N2 — CID 106188444

IUPACN-(3-methylbut-2-enyl)-2,3,4,5-tetrahydropyridin-6-amine
SMILESCC(C)=CCNC1=NCCCC1
InChIInChI=1S/C10H18N2/c1-9(2)6-8-12-10-5-3-4-7-11-10/h6H,3-5,7-8H2,1-2H3,(H,11,12)
InChIKeyOXHSUCCNASQPHG-UHFFFAOYSA-N
MW166.27 g/mol
LogP2.12
Rot. Bonds2

About N-(3-methylbut-2-enyl)-2,3,4,5-tetrahydropyridin-6-amine

N-(3-methylbut-2-enyl)-2,3,4,5-tetrahydropyridin-6-amine (PubChem CID 106188444) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is N-(3-methylbut-2-enyl)-2,3,4,5-tetrahydropyridin-6-amine.

Molecular Properties

Compound NameN-(3-methylbut-2-enyl)-2,3,4,5-tetrahydropyridin-6-amine
PubChem CID106188444
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC NameN-(3-methylbut-2-enyl)-2,3,4,5-tetrahydropyridin-6-amine
SMILESCC(C)=CCNC1=NCCCC1
InChIInChI=1S/C10H18N2/c1-9(2)6-8-12-10-5-3-4-7-11-10/h6H,3-5,7-8H2,1-2H3,(H,11,12)
InChIKeyOXHSUCCNASQPHG-UHFFFAOYSA-N
XLogP2.12
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-Ethyl-2-prop-1-en-2-yl-1,4,5,6-tetrahydropyrimidine
CID 22756056
N-pentyl-2H-pyrrol-5-amine
CID 67916644
N'-methyl-N-(3-methylhex-3-enyl)propanimidamide
CID 91334191
(E)-N-ethyl-N',2-dimethylbut-2-enimidamide
CID 118973189
N'-methyl-N-(2-methylbut-2-enyl)propanimidamide
CID 123564371
5-ethyl-2-N,6-N-dipentyl-3H-pyridine-2,6-diimine
CID 137053042
(5Z)-N-ethyl-5-ethylidene-3,4-dihydro-2H-pyridin-6-amine
CID 153562310
N-(Prop-2-en-1-yl)-3,4,5,6-tetrahydropyridin-2-amine
CID 56972751
N-(3-methylbut-2-enyl)-3,4-dihydro-2H-pyrrol-5-amine
CID 106188411
N-(3-methylbut-2-enyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
CID 106188472
N-(2-methylprop-2-enyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
CID 114616706
N-(2-methylprop-2-enyl)-3,4-dihydro-2H-pyrrol-5-amine
CID 114616825

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbut-2-enyl)-2,3,4,5-tetrahydropyridin-6-amine?
The IUPAC name of N-(3-methylbut-2-enyl)-2,3,4,5-tetrahydropyridin-6-amine (CID 106188444) is N-(3-methylbut-2-enyl)-2,3,4,5-tetrahydropyridin-6-amine.
What is the SMILES notation for N-(3-methylbut-2-enyl)-2,3,4,5-tetrahydropyridin-6-amine?
The canonical SMILES for N-(3-methylbut-2-enyl)-2,3,4,5-tetrahydropyridin-6-amine is CC(C)=CCNC1=NCCCC1.
What is the InChIKey of N-(3-methylbut-2-enyl)-2,3,4,5-tetrahydropyridin-6-amine?
The InChIKey is OXHSUCCNASQPHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-9(2)6-8-12-10-5-3-4-7-11-10/h6H,3-5,7-8H2,1-2H3,(H,11,12).
What are the key properties of N-(3-methylbut-2-enyl)-2,3,4,5-tetrahydropyridin-6-amine?
N-(3-methylbut-2-enyl)-2,3,4,5-tetrahydropyridin-6-amine has a molecular weight of 166.27 g/mol, XLogP of 2.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbut-2-enyl)-2,3,4,5-tetrahydropyridin-6-amine is sourced from PubChem (CID 106188444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).