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

C11H25N — CID 90729081

IUPACN-methyl-N-(3-methylbutan-2-yl)pentan-2-amine
SMILESCCCC(C)N(C)C(C)C(C)C
InChIInChI=1S/C11H25N/c1-7-8-10(4)12(6)11(5)9(2)3/h9-11H,7-8H2,1-6H3
InChIKeyIGDQNTHLWCPCAJ-UHFFFAOYSA-N
MW171.33 g/mol
LogP3.15
Rot. Bonds5

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

N-methyl-N-(3-methylbutan-2-yl)pentan-2-amine (PubChem CID 90729081) has the molecular formula C11H25N and a molecular weight of 171.33 g/mol. Its IUPAC name is N-methyl-N-(3-methylbutan-2-yl)pentan-2-amine.

Molecular Properties

Compound NameN-methyl-N-(3-methylbutan-2-yl)pentan-2-amine
PubChem CID90729081
Molecular FormulaC11H25N
Molecular Weight171.33 g/mol
Exact Mass171.20
IUPAC NameN-methyl-N-(3-methylbutan-2-yl)pentan-2-amine
SMILESCCCC(C)N(C)C(C)C(C)C
InChIInChI=1S/C11H25N/c1-7-8-10(4)12(6)11(5)9(2)3/h9-11H,7-8H2,1-6H3
InChIKeyIGDQNTHLWCPCAJ-UHFFFAOYSA-N
XLogP3.15
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.33
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-3-[methyl(pentan-2-yl)amino]butanoic acid
CID 79407225
3-methyl-2-[methyl(pentan-2-yl)amino]butanoic acid
CID 43572314
2-N-methyl-2-N-(3-methylbutan-2-yl)hexane-1,2-diamine
CID 61353943
3-N-methyl-3-N-(3-methylbutan-2-yl)-1-N-(2-methylpropyl)butane-1,3-diamine
CID 62433937
1-N-tert-butyl-3-N,2-dimethyl-3-N-pentan-2-ylbutane-1,3-diamine
CID 79409030
(5S)-N,4,5-trimethyl-N-pentan-2-ylheptan-2-amine
CID 163911487
1-N,4-N-dimethyl-4-N-pentan-2-ylpentane-1,4-diamine
CID 62432184
ethane;(2R)-N-ethyl-N-methylpentan-2-amine
CID 142583789
but-1-ene;N,N-dimethylpentan-2-amine;ethane
CID 145343513
1-N-ethyl-2-N-methyl-2-N-pentan-2-ylbutane-1,2-diamine
CID 62432362
5-methoxy-4-N-methyl-4-N-pentan-2-ylpentane-1,4-diamine
CID 103391711
N,N-dihydroxypentan-2-amine
CID 87329779

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(3-methylbutan-2-yl)pentan-2-amine?
The IUPAC name of N-methyl-N-(3-methylbutan-2-yl)pentan-2-amine (CID 90729081) is N-methyl-N-(3-methylbutan-2-yl)pentan-2-amine.
What is the SMILES notation for N-methyl-N-(3-methylbutan-2-yl)pentan-2-amine?
The canonical SMILES for N-methyl-N-(3-methylbutan-2-yl)pentan-2-amine is CCCC(C)N(C)C(C)C(C)C.
What is the InChIKey of N-methyl-N-(3-methylbutan-2-yl)pentan-2-amine?
The InChIKey is IGDQNTHLWCPCAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N/c1-7-8-10(4)12(6)11(5)9(2)3/h9-11H,7-8H2,1-6H3.
What are the key properties of N-methyl-N-(3-methylbutan-2-yl)pentan-2-amine?
N-methyl-N-(3-methylbutan-2-yl)pentan-2-amine has a molecular weight of 171.33 g/mol, XLogP of 3.15, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(3-methylbutan-2-yl)pentan-2-amine is sourced from PubChem (CID 90729081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).