3-butyl-3-methyl-2H-pyridin-2-amine

C10H18N2 — CID 90010536

IUPAC3-butyl-3-methyl-2H-pyridin-2-amine
SMILESCCCCC1(C)C=CC=NC1N
InChIInChI=1S/C10H18N2/c1-3-4-6-10(2)7-5-8-12-9(10)11/h5,7-9H,3-4,6,11H2,1-2H3
InChIKeyPHFNMUZIHPEXBL-UHFFFAOYSA-N
MW166.27 g/mol
LogP2.11
Rot. Bonds3

About 3-butyl-3-methyl-2H-pyridin-2-amine

3-butyl-3-methyl-2H-pyridin-2-amine (PubChem CID 90010536) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 3-butyl-3-methyl-2H-pyridin-2-amine.

Molecular Properties

Compound Name3-butyl-3-methyl-2H-pyridin-2-amine
PubChem CID90010536
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name3-butyl-3-methyl-2H-pyridin-2-amine
SMILESCCCCC1(C)C=CC=NC1N
InChIInChI=1S/C10H18N2/c1-3-4-6-10(2)7-5-8-12-9(10)11/h5,7-9H,3-4,6,11H2,1-2H3
InChIKeyPHFNMUZIHPEXBL-UHFFFAOYSA-N
XLogP2.11
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-butyl-3-methyl-2H-pyridin-2-amine?
The IUPAC name of 3-butyl-3-methyl-2H-pyridin-2-amine (CID 90010536) is 3-butyl-3-methyl-2H-pyridin-2-amine.
What is the SMILES notation for 3-butyl-3-methyl-2H-pyridin-2-amine?
The canonical SMILES for 3-butyl-3-methyl-2H-pyridin-2-amine is CCCCC1(C)C=CC=NC1N.
What is the InChIKey of 3-butyl-3-methyl-2H-pyridin-2-amine?
The InChIKey is PHFNMUZIHPEXBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-3-4-6-10(2)7-5-8-12-9(10)11/h5,7-9H,3-4,6,11H2,1-2H3.
What are the key properties of 3-butyl-3-methyl-2H-pyridin-2-amine?
3-butyl-3-methyl-2H-pyridin-2-amine has a molecular weight of 166.27 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-butyl-3-methyl-2H-pyridin-2-amine is sourced from PubChem (CID 90010536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).