3-methyl-N-(2-methylbutan-2-yl)pentan-3-amine

C11H25N — CID 12618974

IUPAC3-methyl-N-(2-methylbutan-2-yl)pentan-3-amine
SMILESCCC(C)(C)NC(C)(CC)CC
InChIInChI=1S/C11H25N/c1-7-10(4,5)12-11(6,8-2)9-3/h12H,7-9H2,1-6H3
InChIKeyFQVHRENEGYTFHA-UHFFFAOYSA-N
MW171.33 g/mol
LogP3.34
Rot. Bonds5

About 3-methyl-N-(2-methylbutan-2-yl)pentan-3-amine

3-methyl-N-(2-methylbutan-2-yl)pentan-3-amine (PubChem CID 12618974) has the molecular formula C11H25N and a molecular weight of 171.33 g/mol. Its IUPAC name is 3-methyl-N-(2-methylbutan-2-yl)pentan-3-amine.

Molecular Properties

Compound Name3-methyl-N-(2-methylbutan-2-yl)pentan-3-amine
PubChem CID12618974
Molecular FormulaC11H25N
Molecular Weight171.33 g/mol
Exact Mass171.20
IUPAC Name3-methyl-N-(2-methylbutan-2-yl)pentan-3-amine
SMILESCCC(C)(C)NC(C)(CC)CC
InChIInChI=1S/C11H25N/c1-7-10(4,5)12-11(6,8-2)9-3/h12H,7-9H2,1-6H3
InChIKeyFQVHRENEGYTFHA-UHFFFAOYSA-N
XLogP3.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.33
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2-methylbutan-2-yl)pentan-3-amine?
The IUPAC name of 3-methyl-N-(2-methylbutan-2-yl)pentan-3-amine (CID 12618974) is 3-methyl-N-(2-methylbutan-2-yl)pentan-3-amine.
What is the SMILES notation for 3-methyl-N-(2-methylbutan-2-yl)pentan-3-amine?
The canonical SMILES for 3-methyl-N-(2-methylbutan-2-yl)pentan-3-amine is CCC(C)(C)NC(C)(CC)CC.
What is the InChIKey of 3-methyl-N-(2-methylbutan-2-yl)pentan-3-amine?
The InChIKey is FQVHRENEGYTFHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N/c1-7-10(4,5)12-11(6,8-2)9-3/h12H,7-9H2,1-6H3.
What are the key properties of 3-methyl-N-(2-methylbutan-2-yl)pentan-3-amine?
3-methyl-N-(2-methylbutan-2-yl)pentan-3-amine has a molecular weight of 171.33 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-methylbutan-2-yl)pentan-3-amine is sourced from PubChem (CID 12618974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).