ethane;2-methyl-3-propan-2-ylpyridine

C11H19N — CID 142858508

IUPACethane;2-methyl-3-propan-2-ylpyridine
SMILESCC.Cc1ncccc1C(C)C
InChIInChI=1S/C9H13N.C2H6/c1-7(2)9-5-4-6-10-8(9)3;1-2/h4-7H,1-3H3;1-2H3
InChIKeyKFTHQKLFCCTYGK-UHFFFAOYSA-N
MW165.28 g/mol
LogP3.54
Rot. Bonds1

About ethane;2-methyl-3-propan-2-ylpyridine

ethane;2-methyl-3-propan-2-ylpyridine (PubChem CID 142858508) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is ethane;2-methyl-3-propan-2-ylpyridine.

Molecular Properties

Compound Nameethane;2-methyl-3-propan-2-ylpyridine
PubChem CID142858508
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Nameethane;2-methyl-3-propan-2-ylpyridine
SMILESCC.Cc1ncccc1C(C)C
InChIInChI=1S/C9H13N.C2H6/c1-7(2)9-5-4-6-10-8(9)3;1-2/h4-7H,1-3H3;1-2H3
InChIKeyKFTHQKLFCCTYGK-UHFFFAOYSA-N
XLogP3.54
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;2-methyl-3-propan-2-ylpyridine;vanadium
CID 143650392
(1S)-1-(2-methyl-3-pyridinyl)ethanamine
CID 94864826
ethane;3-heptan-4-yl-2-methylpyridine
CID 143825065
ethane;(1S)-1-(2-methyl-3-pyridinyl)propan-1-ol
CID 144739559
2-bromo-3-propan-2-ylpyridine
CID 23436869
2-iodo-3-propan-2-ylpyridine
CID 23436890
3-methyl-1-(2-methyl-3-pyridinyl)butan-1-ol
CID 105076232
N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine
CID 105082350
ethane;2-methoxy-3-propan-2-ylpyridine
CID 155741549
(1R)-2-amino-1-(2-methyl-3-pyridinyl)ethanol
CID 96635768
bis(2,3-dimethylpyridine);ethane
CID 159594018
N,4-dimethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine
CID 105126712

Frequently Asked Questions

What is the IUPAC name of ethane;2-methyl-3-propan-2-ylpyridine?
The IUPAC name of ethane;2-methyl-3-propan-2-ylpyridine (CID 142858508) is ethane;2-methyl-3-propan-2-ylpyridine.
What is the SMILES notation for ethane;2-methyl-3-propan-2-ylpyridine?
The canonical SMILES for ethane;2-methyl-3-propan-2-ylpyridine is CC.Cc1ncccc1C(C)C.
What is the InChIKey of ethane;2-methyl-3-propan-2-ylpyridine?
The InChIKey is KFTHQKLFCCTYGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N.C2H6/c1-7(2)9-5-4-6-10-8(9)3;1-2/h4-7H,1-3H3;1-2H3.
What are the key properties of ethane;2-methyl-3-propan-2-ylpyridine?
ethane;2-methyl-3-propan-2-ylpyridine has a molecular weight of 165.28 g/mol, XLogP of 3.54, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methyl-3-propan-2-ylpyridine is sourced from PubChem (CID 142858508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).