N-[(3-methoxyphenyl)methyl]-1-(1-methoxypropan-2-yl)imidazol-2-amine

C15H21N3O2 — CID 106563491

IUPACN-[(3-methoxyphenyl)methyl]-1-(1-methoxypropan-2-yl)imidazol-2-amine
SMILESCOCC(C)n1ccnc1NCc1cccc(OC)c1
InChIInChI=1S/C15H21N3O2/c1-12(11-19-2)18-8-7-16-15(18)17-10-13-5-4-6-14(9-13)20-3/h4-9,12H,10-11H2,1-3H3,(H,16,17)
InChIKeyILBWXLVJIDDLHD-UHFFFAOYSA-N
MW275.35 g/mol
LogP2.71
Rot. Bonds7

About N-[(3-methoxyphenyl)methyl]-1-(1-methoxypropan-2-yl)imidazol-2-amine

N-[(3-methoxyphenyl)methyl]-1-(1-methoxypropan-2-yl)imidazol-2-amine (PubChem CID 106563491) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is N-[(3-methoxyphenyl)methyl]-1-(1-methoxypropan-2-yl)imidazol-2-amine.

Molecular Properties

Compound NameN-[(3-methoxyphenyl)methyl]-1-(1-methoxypropan-2-yl)imidazol-2-amine
PubChem CID106563491
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC NameN-[(3-methoxyphenyl)methyl]-1-(1-methoxypropan-2-yl)imidazol-2-amine
SMILESCOCC(C)n1ccnc1NCc1cccc(OC)c1
InChIInChI=1S/C15H21N3O2/c1-12(11-19-2)18-8-7-16-15(18)17-10-13-5-4-6-14(9-13)20-3/h4-9,12H,10-11H2,1-3H3,(H,16,17)
InChIKeyILBWXLVJIDDLHD-UHFFFAOYSA-N
XLogP2.71
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 ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(3-chloro-4-fluorophenyl)methyl]-1-(1-methoxypropan-2-yl)imidazol-2-amine
CID 106570194
N-(2,2-dimethylpropyl)-1-(1-methoxypropan-2-yl)imidazol-2-amine
CID 106563648
(2S)-1-methoxy-N-[(3-methoxyphenyl)methyl]propan-2-amine
CID 781281
1-(2-methoxyethyl)-N-[(3-methylphenyl)methyl]imidazol-2-amine
CID 106563271
2-N-[(3-methoxyphenyl)methyl]pyridine-2,3-diamine
CID 61029303
3-methoxy-N-[[3-(2-methylpropoxy)phenyl]methyl]aniline
CID 39386919
1-(1-methoxypropan-2-yl)-N-(2-pyrrolidin-1-ylethyl)imidazol-2-amine
CID 106570244
N-[(3-methoxyphenyl)methyl]-4-methyl-1-(2-methylpropyl)imidazol-2-amine
CID 106563494
4-N-[(3-methoxyphenyl)methyl]-2-N-methylpyridine-2,4-diamine
CID 113367561
2,5-dimethoxy-N-[[3-(2-methylpropoxy)phenyl]methyl]aniline
CID 54796992
1-(1-methoxypropan-2-yl)-4-methyl-N-(pyridin-3-ylmethyl)imidazol-2-amine
CID 106560455
4-(2-methoxyethoxy)-N-[(3-methoxyphenyl)methyl]aniline
CID 43734134

Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxyphenyl)methyl]-1-(1-methoxypropan-2-yl)imidazol-2-amine?
The IUPAC name of N-[(3-methoxyphenyl)methyl]-1-(1-methoxypropan-2-yl)imidazol-2-amine (CID 106563491) is N-[(3-methoxyphenyl)methyl]-1-(1-methoxypropan-2-yl)imidazol-2-amine.
What is the SMILES notation for N-[(3-methoxyphenyl)methyl]-1-(1-methoxypropan-2-yl)imidazol-2-amine?
The canonical SMILES for N-[(3-methoxyphenyl)methyl]-1-(1-methoxypropan-2-yl)imidazol-2-amine is COCC(C)n1ccnc1NCc1cccc(OC)c1.
What is the InChIKey of N-[(3-methoxyphenyl)methyl]-1-(1-methoxypropan-2-yl)imidazol-2-amine?
The InChIKey is ILBWXLVJIDDLHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-12(11-19-2)18-8-7-16-15(18)17-10-13-5-4-6-14(9-13)20-3/h4-9,12H,10-11H2,1-3H3,(H,16,17).
What are the key properties of N-[(3-methoxyphenyl)methyl]-1-(1-methoxypropan-2-yl)imidazol-2-amine?
N-[(3-methoxyphenyl)methyl]-1-(1-methoxypropan-2-yl)imidazol-2-amine has a molecular weight of 275.35 g/mol, XLogP of 2.71, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxyphenyl)methyl]-1-(1-methoxypropan-2-yl)imidazol-2-amine is sourced from PubChem (CID 106563491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).