N-[1-[(5,5-dimethyloxolan-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide

C10H18N4O3 — CID 19965226

IUPACN-[1-[(5,5-dimethyloxolan-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide
SMILESCC1(C)CC(CN2CCN=C2N[N+](=O)[O-])CO1
InChIInChI=1S/C10H18N4O3/c1-10(2)5-8(7-17-10)6-13-4-3-11-9(13)12-14(15)16/h8H,3-7H2,1-2H3,(H,11,12)
InChIKeyPJTLDTDIKDZRAN-UHFFFAOYSA-N
MW242.28 g/mol
LogP0.25
Rot. Bonds3

About N-[1-[(5,5-dimethyloxolan-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide

N-[1-[(5,5-dimethyloxolan-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide (PubChem CID 19965226) has the molecular formula C10H18N4O3 and a molecular weight of 242.28 g/mol. Its IUPAC name is N-[1-[(5,5-dimethyloxolan-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide.

Molecular Properties

Compound NameN-[1-[(5,5-dimethyloxolan-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide
PubChem CID19965226
Molecular FormulaC10H18N4O3
Molecular Weight242.28 g/mol
Exact Mass242.14
IUPAC NameN-[1-[(5,5-dimethyloxolan-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide
SMILESCC1(C)CC(CN2CCN=C2N[N+](=O)[O-])CO1
InChIInChI=1S/C10H18N4O3/c1-10(2)5-8(7-17-10)6-13-4-3-11-9(13)12-14(15)16/h8H,3-7H2,1-2H3,(H,11,12)
InChIKeyPJTLDTDIKDZRAN-UHFFFAOYSA-N
XLogP0.25
TPSA80.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'N-nitroso', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-[1-[(5,5-dimethyloxolan-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[1-[(5,5-dimethyloxolan-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide?
The IUPAC name of N-[1-[(5,5-dimethyloxolan-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide (CID 19965226) is N-[1-[(5,5-dimethyloxolan-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide.
What is the SMILES notation for N-[1-[(5,5-dimethyloxolan-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide?
The canonical SMILES for N-[1-[(5,5-dimethyloxolan-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide is CC1(C)CC(CN2CCN=C2N[N+](=O)[O-])CO1.
What is the InChIKey of N-[1-[(5,5-dimethyloxolan-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide?
The InChIKey is PJTLDTDIKDZRAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O3/c1-10(2)5-8(7-17-10)6-13-4-3-11-9(13)12-14(15)16/h8H,3-7H2,1-2H3,(H,11,12).
What are the key properties of N-[1-[(5,5-dimethyloxolan-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide?
N-[1-[(5,5-dimethyloxolan-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide has a molecular weight of 242.28 g/mol, XLogP of 0.25, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(5,5-dimethyloxolan-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide is sourced from PubChem (CID 19965226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).