N-(4-methoxy-3-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine

C15H21N3O2 — CID 106564104

IUPACN-(4-methoxy-3-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine
SMILESCOCCCn1ccnc1Nc1ccc(OC)c(C)c1
InChIInChI=1S/C15H21N3O2/c1-12-11-13(5-6-14(12)20-3)17-15-16-7-9-18(15)8-4-10-19-2/h5-7,9,11H,4,8,10H2,1-3H3,(H,16,17)
InChIKeyCDZDVLFDGDNTFX-UHFFFAOYSA-N
MW275.35 g/mol
LogP2.98
Rot. Bonds7

About N-(4-methoxy-3-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine

N-(4-methoxy-3-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine (PubChem CID 106564104) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is N-(4-methoxy-3-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine.

Molecular Properties

Compound NameN-(4-methoxy-3-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine
PubChem CID106564104
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC NameN-(4-methoxy-3-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine
SMILESCOCCCn1ccnc1Nc1ccc(OC)c(C)c1
InChIInChI=1S/C15H21N3O2/c1-12-11-13(5-6-14(12)20-3)17-15-16-7-9-18(15)8-4-10-19-2/h5-7,9,11H,4,8,10H2,1-3H3,(H,16,17)
InChIKeyCDZDVLFDGDNTFX-UHFFFAOYSA-N
XLogP2.98
TPSA48.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(4-iodophenyl)-1-(3-methoxypropyl)imidazol-2-amine
CID 106554175
N-(4-bromo-3-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine
CID 106557048
1-(3-methoxypropyl)-N-(4-propoxyphenyl)imidazol-2-amine
CID 106569649
5-fluoro-N-[1-(3-methoxypropyl)imidazol-2-yl]pyridin-3-amine
CID 114254404
N-(2-fluoro-4-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine
CID 106560415
N-(2-chloro-6-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine
CID 106576265
N-(2-fluoro-6-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine
CID 106581649
N-(2-chloro-5-methoxyphenyl)-1-(3-methoxypropyl)imidazol-2-amine
CID 106563995
4-methoxy-3-methyl-N-[2-(2-methylimidazol-1-yl)ethyl]aniline
CID 54964565
1-(3-methoxypropyl)-N-[(4-methylphenyl)methyl]imidazol-2-amine
CID 106559873
1-butyl-N-(4-methoxy-3-methylphenyl)-4-methylimidazol-2-amine
CID 106564087
N-(3-chlorophenyl)-1-(2-methoxyethyl)imidazol-2-amine
CID 106558420

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-3-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine?
The IUPAC name of N-(4-methoxy-3-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine (CID 106564104) is N-(4-methoxy-3-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine.
What is the SMILES notation for N-(4-methoxy-3-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine?
The canonical SMILES for N-(4-methoxy-3-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine is COCCCn1ccnc1Nc1ccc(OC)c(C)c1.
What is the InChIKey of N-(4-methoxy-3-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine?
The InChIKey is CDZDVLFDGDNTFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-12-11-13(5-6-14(12)20-3)17-15-16-7-9-18(15)8-4-10-19-2/h5-7,9,11H,4,8,10H2,1-3H3,(H,16,17).
What are the key properties of N-(4-methoxy-3-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine?
N-(4-methoxy-3-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine has a molecular weight of 275.35 g/mol, XLogP of 2.98, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-3-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine is sourced from PubChem (CID 106564104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).