1-(2-methoxyethyl)-5-methyl-5-(4-propan-2-yloxyphenyl)-4H-imidazol-2-amine

C16H25N3O2 — CID 79503010

IUPAC1-(2-methoxyethyl)-5-methyl-5-(4-propan-2-yloxyphenyl)-4H-imidazol-2-amine
SMILESCOCCN1C(N)=NCC1(C)c1ccc(OC(C)C)cc1
InChIInChI=1S/C16H25N3O2/c1-12(2)21-14-7-5-13(6-8-14)16(3)11-18-15(17)19(16)9-10-20-4/h5-8,12H,9-11H2,1-4H3,(H2,17,18)
InChIKeyDQHRUNQRAHKHRO-UHFFFAOYSA-N
MW291.40 g/mol
LogP1.97
Rot. Bonds6

About 1-(2-methoxyethyl)-5-methyl-5-(4-propan-2-yloxyphenyl)-4H-imidazol-2-amine

1-(2-methoxyethyl)-5-methyl-5-(4-propan-2-yloxyphenyl)-4H-imidazol-2-amine (PubChem CID 79503010) has the molecular formula C16H25N3O2 and a molecular weight of 291.40 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-5-methyl-5-(4-propan-2-yloxyphenyl)-4H-imidazol-2-amine.

Molecular Properties

Compound Name1-(2-methoxyethyl)-5-methyl-5-(4-propan-2-yloxyphenyl)-4H-imidazol-2-amine
PubChem CID79503010
Molecular FormulaC16H25N3O2
Molecular Weight291.40 g/mol
Exact Mass291.19
IUPAC Name1-(2-methoxyethyl)-5-methyl-5-(4-propan-2-yloxyphenyl)-4H-imidazol-2-amine
SMILESCOCCN1C(N)=NCC1(C)c1ccc(OC(C)C)cc1
InChIInChI=1S/C16H25N3O2/c1-12(2)21-14-7-5-13(6-8-14)16(3)11-18-15(17)19(16)9-10-20-4/h5-8,12H,9-11H2,1-4H3,(H2,17,18)
InChIKeyDQHRUNQRAHKHRO-UHFFFAOYSA-N
XLogP1.97
TPSA60.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-Imidazoline, 1-(2-(diethylamino)ethyl)-5-(p-methoxyphenyl)-2-methyl-
CID 60540
4-{(4S,5R)-5-[4-(2-Dimethylamino-ethoxy)-phenyl]-4,5-dihydro-1H-imidazol-4-yl}-phenol
CID 11338484
(3R,4aR,7R)-7-(phenoxymethyl)-3-phenyl-3,4,4a,5,6,7-hexahydropyrrolo[1,2-c]pyrimidin-1-amine;hydrochloride
CID 76325227
1-cyclopropyl-2-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1-methylguanidine
CID 97878099
5-[4-(2-fluoroethoxy)phenyl]-4,5-dihydro-1H-imidazol-2-amine
CID 59470568
(5R)-5-[4-(difluoromethoxy)phenyl]-3-methyl-5-(3-pent-4-enoxyphenyl)-4H-imidazol-2-amine
CID 68718959
(4R)-4-(3-but-3-enoxyphenyl)-4-[4-(difluoromethoxy)phenyl]-1-methyl-5-methylideneimidazol-2-amine
CID 70297520
4-(3-But-3-enoxyphenyl)-4-[4-(difluoromethoxy)phenyl]-1-methyl-5-methylideneimidazol-2-amine
CID 70298026
(4R)-4-[4-(difluoromethoxy)phenyl]-1-methyl-4-[3-(2-methylbut-3-enoxy)phenyl]-5-methylideneimidazol-2-amine
CID 70298748
(4R)-4-[4-(difluoromethoxy)cyclohexa-2,4-dien-1-yl]-1-methyl-5-methylidene-4-[3-[(2S)-pent-4-en-2-yl]oxyphenyl]imidazol-2-amine
CID 70298818
5-[4-(2-fluoroethoxy)phenyl]-4,5-dihydro-1H-imidazol-3-ium-2-amine
CID 90864119
2-amino-5-(3,5-difluorophenyl)-5-(3-fluoro-4-methoxyphenyl)-3-methyl-4H-imidazol-4-ol
CID 135219448

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-5-methyl-5-(4-propan-2-yloxyphenyl)-4H-imidazol-2-amine?
The IUPAC name of 1-(2-methoxyethyl)-5-methyl-5-(4-propan-2-yloxyphenyl)-4H-imidazol-2-amine (CID 79503010) is 1-(2-methoxyethyl)-5-methyl-5-(4-propan-2-yloxyphenyl)-4H-imidazol-2-amine.
What is the SMILES notation for 1-(2-methoxyethyl)-5-methyl-5-(4-propan-2-yloxyphenyl)-4H-imidazol-2-amine?
The canonical SMILES for 1-(2-methoxyethyl)-5-methyl-5-(4-propan-2-yloxyphenyl)-4H-imidazol-2-amine is COCCN1C(N)=NCC1(C)c1ccc(OC(C)C)cc1.
What is the InChIKey of 1-(2-methoxyethyl)-5-methyl-5-(4-propan-2-yloxyphenyl)-4H-imidazol-2-amine?
The InChIKey is DQHRUNQRAHKHRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-12(2)21-14-7-5-13(6-8-14)16(3)11-18-15(17)19(16)9-10-20-4/h5-8,12H,9-11H2,1-4H3,(H2,17,18).
What are the key properties of 1-(2-methoxyethyl)-5-methyl-5-(4-propan-2-yloxyphenyl)-4H-imidazol-2-amine?
1-(2-methoxyethyl)-5-methyl-5-(4-propan-2-yloxyphenyl)-4H-imidazol-2-amine has a molecular weight of 291.40 g/mol, XLogP of 1.97, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-5-methyl-5-(4-propan-2-yloxyphenyl)-4H-imidazol-2-amine is sourced from PubChem (CID 79503010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).