3-butan-2-yl-N,N-dimethylpyridin-2-amine

C11H18N2 — CID 129162816

IUPAC3-butan-2-yl-N,N-dimethylpyridin-2-amine
SMILESCCC(C)c1cccnc1N(C)C
InChIInChI=1S/C11H18N2/c1-5-9(2)10-7-6-8-12-11(10)13(3)4/h6-9H,5H2,1-4H3
InChIKeyYEDFOGXNQJQFFF-UHFFFAOYSA-N
MW178.28 g/mol
LogP2.66
Rot. Bonds3

About 3-butan-2-yl-N,N-dimethylpyridin-2-amine

3-butan-2-yl-N,N-dimethylpyridin-2-amine (PubChem CID 129162816) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is 3-butan-2-yl-N,N-dimethylpyridin-2-amine.

Molecular Properties

Compound Name3-butan-2-yl-N,N-dimethylpyridin-2-amine
PubChem CID129162816
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Name3-butan-2-yl-N,N-dimethylpyridin-2-amine
SMILESCCC(C)c1cccnc1N(C)C
InChIInChI=1S/C11H18N2/c1-5-9(2)10-7-6-8-12-11(10)13(3)4/h6-9H,5H2,1-4H3
InChIKeyYEDFOGXNQJQFFF-UHFFFAOYSA-N
XLogP2.66
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-dimethyl-3-[(1R)-1-(methylamino)ethyl]pyridin-2-amine
CID 130631102
3-dodecan-6-yl-N,N-dimethylpyridin-2-amine
CID 137465666
3-butan-2-yl-2-methoxypyridine
CID 130368185
3-[(3-butan-2-yl-2-pyridinyl)-ethenylamino]cyclobutan-1-ol
CID 170062319
(3R)-3-amino-3-[2-(dimethylamino)-3-pyridinyl]propanenitrile
CID 130671808
2-(2-butan-2-ylphenyl)-3-methylpyridine
CID 130282558
2-[1-[[3-(dimethylamino)pyrazin-2-yl]amino]ethyl]phenol
CID 135096176
3-N-hexan-3-yl-2-N,2-N-dimethylpyridine-2,3-diamine
CID 103096852
5-butan-2-ylquinoxaline
CID 123654553
1-[2-[ethyl(2-methylbutyl)amino]-3-pyridinyl]ethanol
CID 114056156
1-(4-butan-2-ylphenyl)-2-[[2-(dimethylamino)-3-pyridinyl]methyl]guanidine
CID 111055937
2-N,2-N-dimethyl-3-N-propylpyridine-2,3-diamine
CID 43707989

Frequently Asked Questions

What is the IUPAC name of 3-butan-2-yl-N,N-dimethylpyridin-2-amine?
The IUPAC name of 3-butan-2-yl-N,N-dimethylpyridin-2-amine (CID 129162816) is 3-butan-2-yl-N,N-dimethylpyridin-2-amine.
What is the SMILES notation for 3-butan-2-yl-N,N-dimethylpyridin-2-amine?
The canonical SMILES for 3-butan-2-yl-N,N-dimethylpyridin-2-amine is CCC(C)c1cccnc1N(C)C.
What is the InChIKey of 3-butan-2-yl-N,N-dimethylpyridin-2-amine?
The InChIKey is YEDFOGXNQJQFFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2/c1-5-9(2)10-7-6-8-12-11(10)13(3)4/h6-9H,5H2,1-4H3.
What are the key properties of 3-butan-2-yl-N,N-dimethylpyridin-2-amine?
3-butan-2-yl-N,N-dimethylpyridin-2-amine has a molecular weight of 178.28 g/mol, XLogP of 2.66, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-butan-2-yl-N,N-dimethylpyridin-2-amine is sourced from PubChem (CID 129162816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).