2-amino-N-[1-(2-methyl-1-morpholin-4-ylpropan-2-yl)imidazol-4-yl]pentanamide

C16H29N5O2 — CID 67164334

IUPAC2-amino-N-[1-(2-methyl-1-morpholin-4-ylpropan-2-yl)imidazol-4-yl]pentanamide
SMILESCCCC(N)C(=O)Nc1cn(C(C)(C)CN2CCOCC2)cn1
InChIInChI=1S/C16H29N5O2/c1-4-5-13(17)15(22)19-14-10-21(12-18-14)16(2,3)11-20-6-8-23-9-7-20/h10,12-13H,4-9,11,17H2,1-3H3,(H,19,22)
InChIKeyIPYYKQVZIHCJDN-UHFFFAOYSA-N
MW323.44 g/mol
LogP1.02
Rot. Bonds7

About 2-amino-N-[1-(2-methyl-1-morpholin-4-ylpropan-2-yl)imidazol-4-yl]pentanamide

2-amino-N-[1-(2-methyl-1-morpholin-4-ylpropan-2-yl)imidazol-4-yl]pentanamide (PubChem CID 67164334) has the molecular formula C16H29N5O2 and a molecular weight of 323.44 g/mol. Its IUPAC name is 2-amino-N-[1-(2-methyl-1-morpholin-4-ylpropan-2-yl)imidazol-4-yl]pentanamide.

Molecular Properties

Compound Name2-amino-N-[1-(2-methyl-1-morpholin-4-ylpropan-2-yl)imidazol-4-yl]pentanamide
PubChem CID67164334
Molecular FormulaC16H29N5O2
Molecular Weight323.44 g/mol
Exact Mass323.23
IUPAC Name2-amino-N-[1-(2-methyl-1-morpholin-4-ylpropan-2-yl)imidazol-4-yl]pentanamide
SMILESCCCC(N)C(=O)Nc1cn(C(C)(C)CN2CCOCC2)cn1
InChIInChI=1S/C16H29N5O2/c1-4-5-13(17)15(22)19-14-10-21(12-18-14)16(2,3)11-20-6-8-23-9-7-20/h10,12-13H,4-9,11,17H2,1-3H3,(H,19,22)
InChIKeyIPYYKQVZIHCJDN-UHFFFAOYSA-N
XLogP1.02
TPSA85.41 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(2-methyl-1-morpholin-4-ylpropan-2-yl)imidazol-4-yl]pentanamide?
The IUPAC name of 2-amino-N-[1-(2-methyl-1-morpholin-4-ylpropan-2-yl)imidazol-4-yl]pentanamide (CID 67164334) is 2-amino-N-[1-(2-methyl-1-morpholin-4-ylpropan-2-yl)imidazol-4-yl]pentanamide.
What is the SMILES notation for 2-amino-N-[1-(2-methyl-1-morpholin-4-ylpropan-2-yl)imidazol-4-yl]pentanamide?
The canonical SMILES for 2-amino-N-[1-(2-methyl-1-morpholin-4-ylpropan-2-yl)imidazol-4-yl]pentanamide is CCCC(N)C(=O)Nc1cn(C(C)(C)CN2CCOCC2)cn1.
What is the InChIKey of 2-amino-N-[1-(2-methyl-1-morpholin-4-ylpropan-2-yl)imidazol-4-yl]pentanamide?
The InChIKey is IPYYKQVZIHCJDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N5O2/c1-4-5-13(17)15(22)19-14-10-21(12-18-14)16(2,3)11-20-6-8-23-9-7-20/h10,12-13H,4-9,11,17H2,1-3H3,(H,19,22).
What are the key properties of 2-amino-N-[1-(2-methyl-1-morpholin-4-ylpropan-2-yl)imidazol-4-yl]pentanamide?
2-amino-N-[1-(2-methyl-1-morpholin-4-ylpropan-2-yl)imidazol-4-yl]pentanamide has a molecular weight of 323.44 g/mol, XLogP of 1.02, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(2-methyl-1-morpholin-4-ylpropan-2-yl)imidazol-4-yl]pentanamide is sourced from PubChem (CID 67164334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).