N,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]butan-2-amine

C15H32N2O — CID 63965449

IUPACN,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]butan-2-amine
SMILESCCC(C)(C)N(C)CC1CCC(CNC(C)C)O1
InChIInChI=1S/C15H32N2O/c1-7-15(4,5)17(6)11-14-9-8-13(18-14)10-16-12(2)3/h12-14,16H,7-11H2,1-6H3
InChIKeyAMQPUTXNPMWCAD-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.65
Rot. Bonds7

About N,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]butan-2-amine

N,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]butan-2-amine (PubChem CID 63965449) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is N,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]butan-2-amine.

Molecular Properties

Compound NameN,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]butan-2-amine
PubChem CID63965449
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC NameN,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]butan-2-amine
SMILESCCC(C)(C)N(C)CC1CCC(CNC(C)C)O1
InChIInChI=1S/C15H32N2O/c1-7-15(4,5)17(6)11-14-9-8-13(18-14)10-16-12(2)3/h12-14,16H,7-11H2,1-6H3
InChIKeyAMQPUTXNPMWCAD-UHFFFAOYSA-N
XLogP2.65
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]butan-2-amine with MolForge

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Related Compounds

N-[[5-[[ethyl(methyl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine
CID 62419141
N-[[5-(aminomethyl)oxolan-2-yl]methyl]-N,2-dimethylbutan-2-amine
CID 63965016
N-(2-methylpropyl)-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]cyclopropanamine
CID 62428846
N-[[5-[[methyl(oxolan-2-ylmethyl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine
CID 62437130
N,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]prop-2-en-1-amine
CID 113498784
N-methyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]aniline
CID 55070066
N-(2-methoxyethyl)-2-methyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]propan-1-amine
CID 62429433
N-[[5-(3,3,3-trifluoropropoxymethyl)oxolan-2-yl]methyl]propan-2-amine
CID 82958605
2-methoxy-N-methyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]aniline
CID 62430750
N-[[5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]oxolan-2-yl]methyl]propan-2-amine
CID 62419615
N-[[5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine
CID 62420415
N-[[5-[(4-tert-butylpiperazin-1-yl)methyl]oxolan-2-yl]methyl]propan-2-amine
CID 62463360

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]butan-2-amine?
The IUPAC name of N,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]butan-2-amine (CID 63965449) is N,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]butan-2-amine.
What is the SMILES notation for N,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]butan-2-amine?
The canonical SMILES for N,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]butan-2-amine is CCC(C)(C)N(C)CC1CCC(CNC(C)C)O1.
What is the InChIKey of N,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]butan-2-amine?
The InChIKey is AMQPUTXNPMWCAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-7-15(4,5)17(6)11-14-9-8-13(18-14)10-16-12(2)3/h12-14,16H,7-11H2,1-6H3.
What are the key properties of N,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]butan-2-amine?
N,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]butan-2-amine has a molecular weight of 256.43 g/mol, XLogP of 2.65, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]butan-2-amine is sourced from PubChem (CID 63965449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).