N,4-dimethyl-N-(2-methylbutan-2-yl)pentan-2-amine

C12H27N — CID 170075954

IUPACN,4-dimethyl-N-(2-methylbutan-2-yl)pentan-2-amine
SMILESCCC(C)(C)N(C)C(C)CC(C)C
InChIInChI=1S/C12H27N/c1-8-12(5,6)13(7)11(4)9-10(2)3/h10-11H,8-9H2,1-7H3
InChIKeyMVKSMTOMSRLKRO-UHFFFAOYSA-N
MW185.35 g/mol
LogP3.54
Rot. Bonds5

About N,4-dimethyl-N-(2-methylbutan-2-yl)pentan-2-amine

N,4-dimethyl-N-(2-methylbutan-2-yl)pentan-2-amine (PubChem CID 170075954) has the molecular formula C12H27N and a molecular weight of 185.35 g/mol. Its IUPAC name is N,4-dimethyl-N-(2-methylbutan-2-yl)pentan-2-amine.

Molecular Properties

Compound NameN,4-dimethyl-N-(2-methylbutan-2-yl)pentan-2-amine
PubChem CID170075954
Molecular FormulaC12H27N
Molecular Weight185.35 g/mol
Exact Mass185.21
IUPAC NameN,4-dimethyl-N-(2-methylbutan-2-yl)pentan-2-amine
SMILESCCC(C)(C)N(C)C(C)CC(C)C
InChIInChI=1S/C12H27N/c1-8-12(5,6)13(7)11(4)9-10(2)3/h10-11H,8-9H2,1-7H3
InChIKeyMVKSMTOMSRLKRO-UHFFFAOYSA-N
XLogP3.54
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.35
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-N-(2-methylbutan-2-yl)heptan-2-amine
CID 123293634
2-ethyl-2-[methyl(4-methylpentan-2-yl)amino]butanoic acid
CID 114996709
1-N-tert-butyl-2-N,3-dimethyl-2-N-(2-methylbutan-2-yl)butane-1,2-diamine
CID 63965886
3-N,3-N,3,6-tetramethylheptane-3,4-diamine
CID 79063853
N,2,4-trimethyl-N-(2-methylbutan-2-yl)pentan-2-amine
CID 88871230
2-[methyl(2-methylbutan-2-yl)amino]propanethioamide
CID 63983607
2-methyl-2-[[methyl(4-methylpentan-2-yl)amino]methyl]butan-1-ol
CID 62266178
3-ethyl-3-N,3-N,4-N,6-tetramethylheptane-3,4-diamine
CID 79062379
1-(2-methylbutan-2-yl)-1-(2-methylpropyl)hydrazine
CID 89257240
2,5,5-trimethylheptan-4-amine
CID 115782662
N,2-dimethyl-N-methylsulfanylbutan-2-amine
CID 168917994
3,3,3-trifluoro-2-N-methyl-2-N-(2-methylbutan-2-yl)propane-1,2-diamine
CID 63982622

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-N-(2-methylbutan-2-yl)pentan-2-amine?
The IUPAC name of N,4-dimethyl-N-(2-methylbutan-2-yl)pentan-2-amine (CID 170075954) is N,4-dimethyl-N-(2-methylbutan-2-yl)pentan-2-amine.
What is the SMILES notation for N,4-dimethyl-N-(2-methylbutan-2-yl)pentan-2-amine?
The canonical SMILES for N,4-dimethyl-N-(2-methylbutan-2-yl)pentan-2-amine is CCC(C)(C)N(C)C(C)CC(C)C.
What is the InChIKey of N,4-dimethyl-N-(2-methylbutan-2-yl)pentan-2-amine?
The InChIKey is MVKSMTOMSRLKRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N/c1-8-12(5,6)13(7)11(4)9-10(2)3/h10-11H,8-9H2,1-7H3.
What are the key properties of N,4-dimethyl-N-(2-methylbutan-2-yl)pentan-2-amine?
N,4-dimethyl-N-(2-methylbutan-2-yl)pentan-2-amine has a molecular weight of 185.35 g/mol, XLogP of 3.54, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-N-(2-methylbutan-2-yl)pentan-2-amine is sourced from PubChem (CID 170075954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).