4-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-morpholin-4-ylpentan-1-amine

C15H28N4O — CID 62748675

IUPAC4-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-morpholin-4-ylpentan-1-amine
SMILESCc1[nH]cnc1CNCC(CC(C)C)N1CCOCC1
InChIInChI=1S/C15H28N4O/c1-12(2)8-14(19-4-6-20-7-5-19)9-16-10-15-13(3)17-11-18-15/h11-12,14,16H,4-10H2,1-3H3,(H,17,18)
InChIKeyDTZIUHZRVJZOQV-UHFFFAOYSA-N
MW280.42 g/mol
LogP1.55
Rot. Bonds7

About 4-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-morpholin-4-ylpentan-1-amine

4-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-morpholin-4-ylpentan-1-amine (PubChem CID 62748675) has the molecular formula C15H28N4O and a molecular weight of 280.42 g/mol. Its IUPAC name is 4-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-morpholin-4-ylpentan-1-amine.

Molecular Properties

Compound Name4-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-morpholin-4-ylpentan-1-amine
PubChem CID62748675
Molecular FormulaC15H28N4O
Molecular Weight280.42 g/mol
Exact Mass280.23
IUPAC Name4-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-morpholin-4-ylpentan-1-amine
SMILESCc1[nH]cnc1CNCC(CC(C)C)N1CCOCC1
InChIInChI=1S/C15H28N4O/c1-12(2)8-14(19-4-6-20-7-5-19)9-16-10-15-13(3)17-11-18-15/h11-12,14,16H,4-10H2,1-3H3,(H,17,18)
InChIKeyDTZIUHZRVJZOQV-UHFFFAOYSA-N
XLogP1.55
TPSA53.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-morpholin-4-ylpentan-1-amine?
The IUPAC name of 4-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-morpholin-4-ylpentan-1-amine (CID 62748675) is 4-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-morpholin-4-ylpentan-1-amine.
What is the SMILES notation for 4-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-morpholin-4-ylpentan-1-amine?
The canonical SMILES for 4-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-morpholin-4-ylpentan-1-amine is Cc1[nH]cnc1CNCC(CC(C)C)N1CCOCC1.
What is the InChIKey of 4-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-morpholin-4-ylpentan-1-amine?
The InChIKey is DTZIUHZRVJZOQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O/c1-12(2)8-14(19-4-6-20-7-5-19)9-16-10-15-13(3)17-11-18-15/h11-12,14,16H,4-10H2,1-3H3,(H,17,18).
What are the key properties of 4-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-morpholin-4-ylpentan-1-amine?
4-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-morpholin-4-ylpentan-1-amine has a molecular weight of 280.42 g/mol, XLogP of 1.55, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-morpholin-4-ylpentan-1-amine is sourced from PubChem (CID 62748675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).