N,2-dimethyl-N-[2-(4-methylpentan-2-yloxy)propyl]propan-2-amine

C14H31NO — CID 139573595

IUPACN,2-dimethyl-N-[2-(4-methylpentan-2-yloxy)propyl]propan-2-amine
SMILESCC(C)CC(C)OC(C)CN(C)C(C)(C)C
InChIInChI=1S/C14H31NO/c1-11(2)9-12(3)16-13(4)10-15(8)14(5,6)7/h11-13H,9-10H2,1-8H3
InChIKeyUEYRIUSKYGLXNV-UHFFFAOYSA-N
MW229.41 g/mol
LogP3.56
Rot. Bonds6

About N,2-dimethyl-N-[2-(4-methylpentan-2-yloxy)propyl]propan-2-amine

N,2-dimethyl-N-[2-(4-methylpentan-2-yloxy)propyl]propan-2-amine (PubChem CID 139573595) has the molecular formula C14H31NO and a molecular weight of 229.41 g/mol. Its IUPAC name is N,2-dimethyl-N-[2-(4-methylpentan-2-yloxy)propyl]propan-2-amine.

Molecular Properties

Compound NameN,2-dimethyl-N-[2-(4-methylpentan-2-yloxy)propyl]propan-2-amine
PubChem CID139573595
Molecular FormulaC14H31NO
Molecular Weight229.41 g/mol
Exact Mass229.24
IUPAC NameN,2-dimethyl-N-[2-(4-methylpentan-2-yloxy)propyl]propan-2-amine
SMILESCC(C)CC(C)OC(C)CN(C)C(C)(C)C
InChIInChI=1S/C14H31NO/c1-11(2)9-12(3)16-13(4)10-15(8)14(5,6)7/h11-13H,9-10H2,1-8H3
InChIKeyUEYRIUSKYGLXNV-UHFFFAOYSA-N
XLogP3.56
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.41
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-[2-(4-methylpentan-2-yloxy)propyl]propan-2-amine?
The IUPAC name of N,2-dimethyl-N-[2-(4-methylpentan-2-yloxy)propyl]propan-2-amine (CID 139573595) is N,2-dimethyl-N-[2-(4-methylpentan-2-yloxy)propyl]propan-2-amine.
What is the SMILES notation for N,2-dimethyl-N-[2-(4-methylpentan-2-yloxy)propyl]propan-2-amine?
The canonical SMILES for N,2-dimethyl-N-[2-(4-methylpentan-2-yloxy)propyl]propan-2-amine is CC(C)CC(C)OC(C)CN(C)C(C)(C)C.
What is the InChIKey of N,2-dimethyl-N-[2-(4-methylpentan-2-yloxy)propyl]propan-2-amine?
The InChIKey is UEYRIUSKYGLXNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO/c1-11(2)9-12(3)16-13(4)10-15(8)14(5,6)7/h11-13H,9-10H2,1-8H3.
What are the key properties of N,2-dimethyl-N-[2-(4-methylpentan-2-yloxy)propyl]propan-2-amine?
N,2-dimethyl-N-[2-(4-methylpentan-2-yloxy)propyl]propan-2-amine has a molecular weight of 229.41 g/mol, XLogP of 3.56, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-[2-(4-methylpentan-2-yloxy)propyl]propan-2-amine is sourced from PubChem (CID 139573595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).