N-methyl-1-propan-2-yloxyhexan-2-amine

C10H23NO — CID 79570657

IUPACN-methyl-1-propan-2-yloxyhexan-2-amine
SMILESCCCCC(COC(C)C)NC
InChIInChI=1S/C10H23NO/c1-5-6-7-10(11-4)8-12-9(2)3/h9-11H,5-8H2,1-4H3
InChIKeyPMWNPETUQACDAG-UHFFFAOYSA-N
MW173.30 g/mol
LogP2.19
Rot. Bonds7

About N-methyl-1-propan-2-yloxyhexan-2-amine

N-methyl-1-propan-2-yloxyhexan-2-amine (PubChem CID 79570657) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is N-methyl-1-propan-2-yloxyhexan-2-amine.

Molecular Properties

Compound NameN-methyl-1-propan-2-yloxyhexan-2-amine
PubChem CID79570657
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC NameN-methyl-1-propan-2-yloxyhexan-2-amine
SMILESCCCCC(COC(C)C)NC
InChIInChI=1S/C10H23NO/c1-5-6-7-10(11-4)8-12-9(2)3/h9-11H,5-8H2,1-4H3
InChIKeyPMWNPETUQACDAG-UHFFFAOYSA-N
XLogP2.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-propan-2-yloxyhexan-2-amine?
The IUPAC name of N-methyl-1-propan-2-yloxyhexan-2-amine (CID 79570657) is N-methyl-1-propan-2-yloxyhexan-2-amine.
What is the SMILES notation for N-methyl-1-propan-2-yloxyhexan-2-amine?
The canonical SMILES for N-methyl-1-propan-2-yloxyhexan-2-amine is CCCCC(COC(C)C)NC.
What is the InChIKey of N-methyl-1-propan-2-yloxyhexan-2-amine?
The InChIKey is PMWNPETUQACDAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-5-6-7-10(11-4)8-12-9(2)3/h9-11H,5-8H2,1-4H3.
What are the key properties of N-methyl-1-propan-2-yloxyhexan-2-amine?
N-methyl-1-propan-2-yloxyhexan-2-amine has a molecular weight of 173.30 g/mol, XLogP of 2.19, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-propan-2-yloxyhexan-2-amine is sourced from PubChem (CID 79570657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).