5-[(2-methoxyphenyl)methyl]-5-methyl-1-(2-methylpropyl)-4H-imidazol-2-amine

C16H25N3O — CID 79498859

IUPAC5-[(2-methoxyphenyl)methyl]-5-methyl-1-(2-methylpropyl)-4H-imidazol-2-amine
SMILESCOc1ccccc1CC1(C)CN=C(N)N1CC(C)C
InChIInChI=1S/C16H25N3O/c1-12(2)10-19-15(17)18-11-16(19,3)9-13-7-5-6-8-14(13)20-4/h5-8,12H,9-11H2,1-4H3,(H2,17,18)
InChIKeySNHQCRQPLXQTGC-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.28
Rot. Bonds5

About 5-[(2-methoxyphenyl)methyl]-5-methyl-1-(2-methylpropyl)-4H-imidazol-2-amine

5-[(2-methoxyphenyl)methyl]-5-methyl-1-(2-methylpropyl)-4H-imidazol-2-amine (PubChem CID 79498859) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is 5-[(2-methoxyphenyl)methyl]-5-methyl-1-(2-methylpropyl)-4H-imidazol-2-amine.

Molecular Properties

Compound Name5-[(2-methoxyphenyl)methyl]-5-methyl-1-(2-methylpropyl)-4H-imidazol-2-amine
PubChem CID79498859
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC Name5-[(2-methoxyphenyl)methyl]-5-methyl-1-(2-methylpropyl)-4H-imidazol-2-amine
SMILESCOc1ccccc1CC1(C)CN=C(N)N1CC(C)C
InChIInChI=1S/C16H25N3O/c1-12(2)10-19-15(17)18-11-16(19,3)9-13-7-5-6-8-14(13)20-4/h5-8,12H,9-11H2,1-4H3,(H2,17,18)
InChIKeySNHQCRQPLXQTGC-UHFFFAOYSA-N
XLogP2.28
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(cyclopropylmethyl)-5-[(2-methoxyphenyl)methyl]-5-methyl-4H-imidazol-2-amine
CID 79521409
5-(2-ethoxyphenyl)-5-methyl-1-(2-methylpropyl)-4H-imidazol-2-amine
CID 79497892
5-benzyl-1-ethyl-5-methyl-4H-imidazol-2-amine
CID 79510395
5-(4-tert-butylphenyl)-5-methyl-1-(2-methylpropyl)-4H-imidazol-2-amine
CID 79498700
5-methyl-1-(2-methylpropyl)-5-[4-(trifluoromethyl)phenyl]-4H-imidazol-2-amine
CID 79498423
5-methyl-1-(2-methylpropyl)-5-(4-propan-2-ylphenyl)-4H-imidazol-2-amine
CID 79498451
1-[2-(dimethylamino)ethyl]-5-[(4-methoxyphenyl)methyl]-5-methyl-4H-imidazol-2-amine
CID 79498021
3-[(2-methoxyphenyl)methyl]-3-(2-methylpropyl)azetidine
CID 79451831
6-[1-[(2-methoxyphenyl)methyl-methylamino]ethyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 17449981
3-(2-methoxyphenyl)-2-methylpropan-1-amine
CID 22024848
1-(2-methylpropyl)-1,3-diazaspiro[4.6]undec-2-en-2-amine
CID 79497099
7-methoxy-1'-(2-methylpropyl)spiro[2,3-dihydro-1H-naphthalene-4,5'-4H-imidazole]-2'-amine
CID 79498420

Frequently Asked Questions

What is the IUPAC name of 5-[(2-methoxyphenyl)methyl]-5-methyl-1-(2-methylpropyl)-4H-imidazol-2-amine?
The IUPAC name of 5-[(2-methoxyphenyl)methyl]-5-methyl-1-(2-methylpropyl)-4H-imidazol-2-amine (CID 79498859) is 5-[(2-methoxyphenyl)methyl]-5-methyl-1-(2-methylpropyl)-4H-imidazol-2-amine.
What is the SMILES notation for 5-[(2-methoxyphenyl)methyl]-5-methyl-1-(2-methylpropyl)-4H-imidazol-2-amine?
The canonical SMILES for 5-[(2-methoxyphenyl)methyl]-5-methyl-1-(2-methylpropyl)-4H-imidazol-2-amine is COc1ccccc1CC1(C)CN=C(N)N1CC(C)C.
What is the InChIKey of 5-[(2-methoxyphenyl)methyl]-5-methyl-1-(2-methylpropyl)-4H-imidazol-2-amine?
The InChIKey is SNHQCRQPLXQTGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-12(2)10-19-15(17)18-11-16(19,3)9-13-7-5-6-8-14(13)20-4/h5-8,12H,9-11H2,1-4H3,(H2,17,18).
What are the key properties of 5-[(2-methoxyphenyl)methyl]-5-methyl-1-(2-methylpropyl)-4H-imidazol-2-amine?
5-[(2-methoxyphenyl)methyl]-5-methyl-1-(2-methylpropyl)-4H-imidazol-2-amine has a molecular weight of 275.40 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-methoxyphenyl)methyl]-5-methyl-1-(2-methylpropyl)-4H-imidazol-2-amine is sourced from PubChem (CID 79498859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).