4-methyl-N-(2-methylpentan-3-yl)-2-morpholin-4-ylpentan-1-amine

C16H34N2O — CID 43769799

IUPAC4-methyl-N-(2-methylpentan-3-yl)-2-morpholin-4-ylpentan-1-amine
SMILESCCC(NCC(CC(C)C)N1CCOCC1)C(C)C
InChIInChI=1S/C16H34N2O/c1-6-16(14(4)5)17-12-15(11-13(2)3)18-7-9-19-10-8-18/h13-17H,6-12H2,1-5H3
InChIKeyRSPBSKRQXKIBDC-UHFFFAOYSA-N
MW270.46 g/mol
LogP2.76
Rot. Bonds8

About 4-methyl-N-(2-methylpentan-3-yl)-2-morpholin-4-ylpentan-1-amine

4-methyl-N-(2-methylpentan-3-yl)-2-morpholin-4-ylpentan-1-amine (PubChem CID 43769799) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is 4-methyl-N-(2-methylpentan-3-yl)-2-morpholin-4-ylpentan-1-amine.

Molecular Properties

Compound Name4-methyl-N-(2-methylpentan-3-yl)-2-morpholin-4-ylpentan-1-amine
PubChem CID43769799
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC Name4-methyl-N-(2-methylpentan-3-yl)-2-morpholin-4-ylpentan-1-amine
SMILESCCC(NCC(CC(C)C)N1CCOCC1)C(C)C
InChIInChI=1S/C16H34N2O/c1-6-16(14(4)5)17-12-15(11-13(2)3)18-7-9-19-10-8-18/h13-17H,6-12H2,1-5H3
InChIKeyRSPBSKRQXKIBDC-UHFFFAOYSA-N
XLogP2.76
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-methylpentan-3-yl)-2-morpholin-4-ylpentan-1-amine?
The IUPAC name of 4-methyl-N-(2-methylpentan-3-yl)-2-morpholin-4-ylpentan-1-amine (CID 43769799) is 4-methyl-N-(2-methylpentan-3-yl)-2-morpholin-4-ylpentan-1-amine.
What is the SMILES notation for 4-methyl-N-(2-methylpentan-3-yl)-2-morpholin-4-ylpentan-1-amine?
The canonical SMILES for 4-methyl-N-(2-methylpentan-3-yl)-2-morpholin-4-ylpentan-1-amine is CCC(NCC(CC(C)C)N1CCOCC1)C(C)C.
What is the InChIKey of 4-methyl-N-(2-methylpentan-3-yl)-2-morpholin-4-ylpentan-1-amine?
The InChIKey is RSPBSKRQXKIBDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-6-16(14(4)5)17-12-15(11-13(2)3)18-7-9-19-10-8-18/h13-17H,6-12H2,1-5H3.
What are the key properties of 4-methyl-N-(2-methylpentan-3-yl)-2-morpholin-4-ylpentan-1-amine?
4-methyl-N-(2-methylpentan-3-yl)-2-morpholin-4-ylpentan-1-amine has a molecular weight of 270.46 g/mol, XLogP of 2.76, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-methylpentan-3-yl)-2-morpholin-4-ylpentan-1-amine is sourced from PubChem (CID 43769799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).