N-[(2R,6R)-2,6-di(propan-2-yl)oxan-4-yl]-N',N'-dimethylethane-1,2-diamine

C15H32N2O — CID 125430986

IUPACN-[(2R,6R)-2,6-di(propan-2-yl)oxan-4-yl]-N',N'-dimethylethane-1,2-diamine
SMILESCC(C)[C@H]1CC(NCCN(C)C)C[C@H](C(C)C)O1
InChIInChI=1S/C15H32N2O/c1-11(2)14-9-13(16-7-8-17(5)6)10-15(18-14)12(3)4/h11-16H,7-10H2,1-6H3/t14-,15-/m1/s1
InChIKeyXEGBUCKUALIEBF-HUUCEWRRSA-N
MW256.43 g/mol
LogP2.37
Rot. Bonds6

About N-[(2R,6R)-2,6-di(propan-2-yl)oxan-4-yl]-N',N'-dimethylethane-1,2-diamine

N-[(2R,6R)-2,6-di(propan-2-yl)oxan-4-yl]-N',N'-dimethylethane-1,2-diamine (PubChem CID 125430986) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is N-[(2R,6R)-2,6-di(propan-2-yl)oxan-4-yl]-N',N'-dimethylethane-1,2-diamine.

Molecular Properties

Compound NameN-[(2R,6R)-2,6-di(propan-2-yl)oxan-4-yl]-N',N'-dimethylethane-1,2-diamine
PubChem CID125430986
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC NameN-[(2R,6R)-2,6-di(propan-2-yl)oxan-4-yl]-N',N'-dimethylethane-1,2-diamine
SMILESCC(C)[C@H]1CC(NCCN(C)C)C[C@H](C(C)C)O1
InChIInChI=1S/C15H32N2O/c1-11(2)14-9-13(16-7-8-17(5)6)10-15(18-14)12(3)4/h11-16H,7-10H2,1-6H3/t14-,15-/m1/s1
InChIKeyXEGBUCKUALIEBF-HUUCEWRRSA-N
XLogP2.37
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(2R,6R)-2,6-di(propan-2-yl)oxan-4-yl]-N',N'-dimethylethane-1,2-diamine with MolForge

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Related Compounds

N-[(2R,6S)-2,6-di(propan-2-yl)oxan-4-yl]-N',N'-diethylpropane-1,3-diamine
CID 125433376
N',N'-dimethyl-N-(1-propan-2-ylazetidin-3-yl)ethane-1,2-diamine
CID 166926926
N'-butan-2-yl-N'-methyl-N-(2-propan-2-yloxan-4-yl)ethane-1,2-diamine
CID 103930680
N',N'-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)ethane-1,2-diamine
CID 16773593
(2R,6R)-N-[(4-methoxyphenyl)methyl]-2,6-di(propan-2-yl)oxan-4-amine
CID 125432814
N',N'-dimethyl-N-spiro[4.5]decan-8-ylethane-1,2-diamine
CID 114816994
N-cyclopropyl-N',N'-bis(2-methylpropyl)ethane-1,2-diamine
CID 61378678
N'-cyclopropyl-N'-ethyl-N-(3-propan-2-ylcyclobutyl)ethane-1,2-diamine
CID 103578407
N'-ethyl-N'-methyl-N-(4-propan-2-ylcyclohexyl)ethane-1,2-diamine
CID 62704092
N-cyclopentyl-N'-methyl-N'-propan-2-ylethane-1,2-diamine
CID 60850712
N',N'-dimethyl-N-(2-methyloxolan-3-yl)ethane-1,2-diamine
CID 82722831
N-cyclooctyl-N'-methyl-N'-propan-2-ylethane-1,2-diamine
CID 62634350

Frequently Asked Questions

What is the IUPAC name of N-[(2R,6R)-2,6-di(propan-2-yl)oxan-4-yl]-N',N'-dimethylethane-1,2-diamine?
The IUPAC name of N-[(2R,6R)-2,6-di(propan-2-yl)oxan-4-yl]-N',N'-dimethylethane-1,2-diamine (CID 125430986) is N-[(2R,6R)-2,6-di(propan-2-yl)oxan-4-yl]-N',N'-dimethylethane-1,2-diamine.
What is the SMILES notation for N-[(2R,6R)-2,6-di(propan-2-yl)oxan-4-yl]-N',N'-dimethylethane-1,2-diamine?
The canonical SMILES for N-[(2R,6R)-2,6-di(propan-2-yl)oxan-4-yl]-N',N'-dimethylethane-1,2-diamine is CC(C)[C@H]1CC(NCCN(C)C)C[C@H](C(C)C)O1.
What is the InChIKey of N-[(2R,6R)-2,6-di(propan-2-yl)oxan-4-yl]-N',N'-dimethylethane-1,2-diamine?
The InChIKey is XEGBUCKUALIEBF-HUUCEWRRSA-N. The full InChI is InChI=1S/C15H32N2O/c1-11(2)14-9-13(16-7-8-17(5)6)10-15(18-14)12(3)4/h11-16H,7-10H2,1-6H3/t14-,15-/m1/s1.
What are the key properties of N-[(2R,6R)-2,6-di(propan-2-yl)oxan-4-yl]-N',N'-dimethylethane-1,2-diamine?
N-[(2R,6R)-2,6-di(propan-2-yl)oxan-4-yl]-N',N'-dimethylethane-1,2-diamine has a molecular weight of 256.43 g/mol, XLogP of 2.37, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R,6R)-2,6-di(propan-2-yl)oxan-4-yl]-N',N'-dimethylethane-1,2-diamine is sourced from PubChem (CID 125430986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).