N,4-dimethyl-5-(5-methyloxolan-2-yl)pentan-2-amine

C12H25NO — CID 103131886

IUPACN,4-dimethyl-5-(5-methyloxolan-2-yl)pentan-2-amine
SMILESCNC(C)CC(C)CC1CCC(C)O1
InChIInChI=1S/C12H25NO/c1-9(7-10(2)13-4)8-12-6-5-11(3)14-12/h9-13H,5-8H2,1-4H3
InChIKeyKAQLFDMCJPLRJL-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.58
Rot. Bonds5

About N,4-dimethyl-5-(5-methyloxolan-2-yl)pentan-2-amine

N,4-dimethyl-5-(5-methyloxolan-2-yl)pentan-2-amine (PubChem CID 103131886) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is N,4-dimethyl-5-(5-methyloxolan-2-yl)pentan-2-amine.

Molecular Properties

Compound NameN,4-dimethyl-5-(5-methyloxolan-2-yl)pentan-2-amine
PubChem CID103131886
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC NameN,4-dimethyl-5-(5-methyloxolan-2-yl)pentan-2-amine
SMILESCNC(C)CC(C)CC1CCC(C)O1
InChIInChI=1S/C12H25NO/c1-9(7-10(2)13-4)8-12-6-5-11(3)14-12/h9-13H,5-8H2,1-4H3
InChIKeyKAQLFDMCJPLRJL-UHFFFAOYSA-N
XLogP2.58
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-3-[(5-methyloxolan-2-yl)methyl]pentan-2-amine
CID 103135831
2-methyl-3-(5-methyloxolan-2-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 103139099
3-methyl-4-(5-methyloxolan-2-yl)butan-2-amine
CID 103131770
N-methyl-2-[(5-methyloxolan-2-yl)methyl]pentan-1-amine
CID 103138192
(2R)-2-[(5-methyloxolan-2-yl)methylamino]propan-1-ol
CID 114985738
N-(2-methoxyethyl)-3-methyl-2-[(5-methyloxolan-2-yl)methyl]butan-1-amine
CID 103138623
1-methoxy-N-[(5-methyloxolan-2-yl)methyl]propan-2-amine
CID 82833761
(2S)-2-methyl-5-[2-(oxolan-2-yl)propyl]oxolane
CID 143383012
2-[2-(bromomethyl)butyl]-5-methyloxolane
CID 103142666
3,3-dimethyl-2-[(5-methyloxolan-2-yl)methyl]butan-1-amine
CID 103138980
2-amino-3-(5-methyloxolan-2-yl)propanamide
CID 103134581
3-methyl-N-[(5-methyloxolan-2-yl)methyl]-2-propan-2-ylbutan-1-amine
CID 102904444

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-5-(5-methyloxolan-2-yl)pentan-2-amine?
The IUPAC name of N,4-dimethyl-5-(5-methyloxolan-2-yl)pentan-2-amine (CID 103131886) is N,4-dimethyl-5-(5-methyloxolan-2-yl)pentan-2-amine.
What is the SMILES notation for N,4-dimethyl-5-(5-methyloxolan-2-yl)pentan-2-amine?
The canonical SMILES for N,4-dimethyl-5-(5-methyloxolan-2-yl)pentan-2-amine is CNC(C)CC(C)CC1CCC(C)O1.
What is the InChIKey of N,4-dimethyl-5-(5-methyloxolan-2-yl)pentan-2-amine?
The InChIKey is KAQLFDMCJPLRJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-9(7-10(2)13-4)8-12-6-5-11(3)14-12/h9-13H,5-8H2,1-4H3.
What are the key properties of N,4-dimethyl-5-(5-methyloxolan-2-yl)pentan-2-amine?
N,4-dimethyl-5-(5-methyloxolan-2-yl)pentan-2-amine has a molecular weight of 199.34 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-5-(5-methyloxolan-2-yl)pentan-2-amine is sourced from PubChem (CID 103131886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).