1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine

C11H21N3O — CID 106554728

IUPAC1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine
SMILESCCCNc1nc(C)cn1C(C)COC
InChIInChI=1S/C11H21N3O/c1-5-6-12-11-13-9(2)7-14(11)10(3)8-15-4/h7,10H,5-6,8H2,1-4H3,(H,12,13)
InChIKeyOYSZBBSTLXJZMC-UHFFFAOYSA-N
MW211.31 g/mol
LogP2.22
Rot. Bonds6

About 1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine

1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine (PubChem CID 106554728) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine.

Molecular Properties

Compound Name1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine
PubChem CID106554728
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine
SMILESCCCNc1nc(C)cn1C(C)COC
InChIInChI=1S/C11H21N3O/c1-5-6-12-11-13-9(2)7-14(11)10(3)8-15-4/h7,10H,5-6,8H2,1-4H3,(H,12,13)
InChIKeyOYSZBBSTLXJZMC-UHFFFAOYSA-N
XLogP2.22
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-butan-2-yl-N-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106554900
1-hexan-2-yl-N-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106569745
1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]imidazol-2-amine
CID 106573349
1-(1-methoxypropan-2-yl)-4-methyl-N-(3-methylbutan-2-yl)imidazol-2-amine
CID 106554321
1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine
CID 106568458
1-(1-cyclopropylpropan-2-yl)-4-methyl-N-propylimidazol-2-amine
CID 106572732
N-(1-methoxy-3-methylbutan-2-yl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106575059
1-(1-methoxypropan-2-yl)-4-methyl-N-(4-methylpentan-2-yl)imidazol-2-amine
CID 106561678
1-butan-2-yl-N-ethyl-4-methylimidazol-2-amine
CID 106554895
N-[[1-(dimethylamino)cyclobutyl]methyl]-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106583085
1-(1-methoxy-3-methylbutan-2-yl)-N-(3-methoxypropyl)-4-methylimidazol-2-amine
CID 106575097
1-(1-methoxypropan-2-yl)-4-methyl-N-(pyridin-3-ylmethyl)imidazol-2-amine
CID 106560455

Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine?
The IUPAC name of 1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine (CID 106554728) is 1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine.
What is the SMILES notation for 1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine?
The canonical SMILES for 1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine is CCCNc1nc(C)cn1C(C)COC.
What is the InChIKey of 1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine?
The InChIKey is OYSZBBSTLXJZMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-5-6-12-11-13-9(2)7-14(11)10(3)8-15-4/h7,10H,5-6,8H2,1-4H3,(H,12,13).
What are the key properties of 1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine?
1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine has a molecular weight of 211.31 g/mol, XLogP of 2.22, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine is sourced from PubChem (CID 106554728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).