N-(3-methoxypropyl)-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine

C14H25N3O2 — CID 106563918

IUPACN-(3-methoxypropyl)-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine
SMILESCOCCCNc1nc(C)cn1CC1CCCCO1
InChIInChI=1S/C14H25N3O2/c1-12-10-17(11-13-6-3-4-9-19-13)14(16-12)15-7-5-8-18-2/h10,13H,3-9,11H2,1-2H3,(H,15,16)
InChIKeyOEQUIPLRESKOMO-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.21
Rot. Bonds7

About N-(3-methoxypropyl)-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine

N-(3-methoxypropyl)-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine (PubChem CID 106563918) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is N-(3-methoxypropyl)-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine.

Molecular Properties

Compound NameN-(3-methoxypropyl)-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine
PubChem CID106563918
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC NameN-(3-methoxypropyl)-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine
SMILESCOCCCNc1nc(C)cn1CC1CCCCO1
InChIInChI=1S/C14H25N3O2/c1-12-10-17(11-13-6-3-4-9-19-13)14(16-12)15-7-5-8-18-2/h10,13H,3-9,11H2,1-2H3,(H,15,16)
InChIKeyOEQUIPLRESKOMO-UHFFFAOYSA-N
XLogP2.21
TPSA48.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(3-methoxypropyl)-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine with MolForge

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

Launch Full Analysis

Related Compounds

N-(3-ethoxypropyl)-4-methyl-1-(oxolan-2-ylmethyl)imidazol-2-amine
CID 106560091
N-ethyl-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine
CID 106563883
N-(3-methoxypropyl)-4-methyl-1-[(1-methylpyrrolidin-3-yl)methyl]imidazol-2-amine
CID 106563068
1-(cyclopentylmethyl)-N-(3-ethoxypropyl)-4-methylimidazol-2-amine
CID 106561789
1-(cyclopropylmethyl)-N-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106555207
1-ethyl-4-methyl-N-[2-(oxolan-2-yl)ethyl]imidazol-2-amine
CID 106567508
N-(2-cyclohexylethyl)-1-(3-methoxypropyl)-4-methylimidazol-2-amine
CID 106563359
N-(3-methoxypropyl)-4-methyl-1-(3-pyrrolidin-1-ylpropyl)imidazol-2-amine
CID 106572086
1-[2-[cyclopropyl(methyl)amino]ethyl]-N-(3-methoxypropyl)-4-methylimidazol-2-amine
CID 106571519
4-methyl-1-(oxolan-2-ylmethyl)-N-phenylimidazol-2-amine
CID 106560077
N-(3-methoxypropyl)-4-methyl-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]imidazol-2-amine
CID 106567823
1-[2-(2-methoxyethoxy)ethyl]-N-(3-methoxypropyl)-4-methylimidazol-2-amine
CID 106564456

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine?
The IUPAC name of N-(3-methoxypropyl)-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine (CID 106563918) is N-(3-methoxypropyl)-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine.
What is the SMILES notation for N-(3-methoxypropyl)-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine?
The canonical SMILES for N-(3-methoxypropyl)-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine is COCCCNc1nc(C)cn1CC1CCCCO1.
What is the InChIKey of N-(3-methoxypropyl)-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine?
The InChIKey is OEQUIPLRESKOMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-12-10-17(11-13-6-3-4-9-19-13)14(16-12)15-7-5-8-18-2/h10,13H,3-9,11H2,1-2H3,(H,15,16).
What are the key properties of N-(3-methoxypropyl)-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine?
N-(3-methoxypropyl)-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine has a molecular weight of 267.37 g/mol, XLogP of 2.21, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine is sourced from PubChem (CID 106563918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).