2,6-di(propan-2-yl)-2,3,4,5-tetrahydropyridine

C11H21N — CID 19382536

IUPAC2,6-di(propan-2-yl)-2,3,4,5-tetrahydropyridine
SMILESCC(C)C1=NC(C(C)C)CCC1
InChIInChI=1S/C11H21N/c1-8(2)10-6-5-7-11(12-10)9(3)4/h8-10H,5-7H2,1-4H3
InChIKeyFBLARJHSGGTUKM-UHFFFAOYSA-N
MW167.30 g/mol
LogP3.29
Rot. Bonds2

About 2,6-di(propan-2-yl)-2,3,4,5-tetrahydropyridine

2,6-di(propan-2-yl)-2,3,4,5-tetrahydropyridine (PubChem CID 19382536) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 2,6-di(propan-2-yl)-2,3,4,5-tetrahydropyridine.

Molecular Properties

Compound Name2,6-di(propan-2-yl)-2,3,4,5-tetrahydropyridine
PubChem CID19382536
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name2,6-di(propan-2-yl)-2,3,4,5-tetrahydropyridine
SMILESCC(C)C1=NC(C(C)C)CCC1
InChIInChI=1S/C11H21N/c1-8(2)10-6-5-7-11(12-10)9(3)4/h8-10H,5-7H2,1-4H3
InChIKeyFBLARJHSGGTUKM-UHFFFAOYSA-N
XLogP3.29
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 546050
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CID 574133
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CID 557874
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CID 637643
CID 637643
CID 11457899
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CID 12229454
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CID 12527862
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CID 12538105
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CID 14663696
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CID 22956980
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CID 53832044
CID 53832044

Frequently Asked Questions

What is the IUPAC name of 2,6-di(propan-2-yl)-2,3,4,5-tetrahydropyridine?
The IUPAC name of 2,6-di(propan-2-yl)-2,3,4,5-tetrahydropyridine (CID 19382536) is 2,6-di(propan-2-yl)-2,3,4,5-tetrahydropyridine.
What is the SMILES notation for 2,6-di(propan-2-yl)-2,3,4,5-tetrahydropyridine?
The canonical SMILES for 2,6-di(propan-2-yl)-2,3,4,5-tetrahydropyridine is CC(C)C1=NC(C(C)C)CCC1.
What is the InChIKey of 2,6-di(propan-2-yl)-2,3,4,5-tetrahydropyridine?
The InChIKey is FBLARJHSGGTUKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-8(2)10-6-5-7-11(12-10)9(3)4/h8-10H,5-7H2,1-4H3.
What are the key properties of 2,6-di(propan-2-yl)-2,3,4,5-tetrahydropyridine?
2,6-di(propan-2-yl)-2,3,4,5-tetrahydropyridine has a molecular weight of 167.30 g/mol, XLogP of 3.29, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-di(propan-2-yl)-2,3,4,5-tetrahydropyridine is sourced from PubChem (CID 19382536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).