N-tert-butyl-3-(5-morpholin-2-ylimidazol-1-yl)propanamide

C14H24N4O2 — CID 114721907

IUPACN-tert-butyl-3-(5-morpholin-2-ylimidazol-1-yl)propanamide
SMILESCC(C)(C)NC(=O)CCn1cncc1C1CNCCO1
InChIInChI=1S/C14H24N4O2/c1-14(2,3)17-13(19)4-6-18-10-16-8-11(18)12-9-15-5-7-20-12/h8,10,12,15H,4-7,9H2,1-3H3,(H,17,19)
InChIKeyRZBYWGZMELFYSU-UHFFFAOYSA-N
MW280.37 g/mol
LogP0.85
Rot. Bonds4

About N-tert-butyl-3-(5-morpholin-2-ylimidazol-1-yl)propanamide

N-tert-butyl-3-(5-morpholin-2-ylimidazol-1-yl)propanamide (PubChem CID 114721907) has the molecular formula C14H24N4O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is N-tert-butyl-3-(5-morpholin-2-ylimidazol-1-yl)propanamide.

Molecular Properties

Compound NameN-tert-butyl-3-(5-morpholin-2-ylimidazol-1-yl)propanamide
PubChem CID114721907
Molecular FormulaC14H24N4O2
Molecular Weight280.37 g/mol
Exact Mass280.19
IUPAC NameN-tert-butyl-3-(5-morpholin-2-ylimidazol-1-yl)propanamide
SMILESCC(C)(C)NC(=O)CCn1cncc1C1CNCCO1
InChIInChI=1S/C14H24N4O2/c1-14(2,3)17-13(19)4-6-18-10-16-8-11(18)12-9-15-5-7-20-12/h8,10,12,15H,4-7,9H2,1-3H3,(H,17,19)
InChIKeyRZBYWGZMELFYSU-UHFFFAOYSA-N
XLogP0.85
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[5-(azetidin-3-yl)imidazol-1-yl]-N-tert-butylpropanamide
CID 114721917
2-[3-(2-propan-2-yloxyethyl)imidazol-4-yl]morpholine
CID 114722434
2-[3-(2-piperidin-1-ylethyl)imidazol-4-yl]morpholine
CID 114718670
2-[3-(2,2-dimethylbutyl)imidazol-4-yl]morpholine
CID 103466943
N,N-diethyl-2-(5-morpholin-2-ylimidazol-1-yl)acetamide
CID 114721947
2-(3-but-3-ynylimidazol-4-yl)morpholine
CID 114720452
2-[3-(2-thiophen-2-ylethyl)imidazol-4-yl]morpholine
CID 114717096
2-[3-(2,2-dicyclopropylethyl)imidazol-4-yl]morpholine
CID 114721021
2-[3-(3-methylpentan-3-yl)imidazol-4-yl]morpholine
CID 106329949
2-[3-[(4-methyl-3-pyridinyl)methyl]imidazol-4-yl]morpholine
CID 114958077
N-tert-butyl-3-[5-(3-methylpyrrolidin-3-yl)imidazol-1-yl]propanamide
CID 114721912
2-[3-[(1,4-dimethylpiperidin-4-yl)methyl]imidazol-4-yl]morpholine
CID 107165712

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-3-(5-morpholin-2-ylimidazol-1-yl)propanamide?
The IUPAC name of N-tert-butyl-3-(5-morpholin-2-ylimidazol-1-yl)propanamide (CID 114721907) is N-tert-butyl-3-(5-morpholin-2-ylimidazol-1-yl)propanamide.
What is the SMILES notation for N-tert-butyl-3-(5-morpholin-2-ylimidazol-1-yl)propanamide?
The canonical SMILES for N-tert-butyl-3-(5-morpholin-2-ylimidazol-1-yl)propanamide is CC(C)(C)NC(=O)CCn1cncc1C1CNCCO1.
What is the InChIKey of N-tert-butyl-3-(5-morpholin-2-ylimidazol-1-yl)propanamide?
The InChIKey is RZBYWGZMELFYSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2/c1-14(2,3)17-13(19)4-6-18-10-16-8-11(18)12-9-15-5-7-20-12/h8,10,12,15H,4-7,9H2,1-3H3,(H,17,19).
What are the key properties of N-tert-butyl-3-(5-morpholin-2-ylimidazol-1-yl)propanamide?
N-tert-butyl-3-(5-morpholin-2-ylimidazol-1-yl)propanamide has a molecular weight of 280.37 g/mol, XLogP of 0.85, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-3-(5-morpholin-2-ylimidazol-1-yl)propanamide is sourced from PubChem (CID 114721907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).