1-(2-methoxyethyl)-4-methyl-N-(2-phenylcyclopropyl)imidazol-2-amine

C16H21N3O — CID 106565504

IUPAC1-(2-methoxyethyl)-4-methyl-N-(2-phenylcyclopropyl)imidazol-2-amine
SMILESCOCCn1cc(C)nc1NC1CC1c1ccccc1
InChIInChI=1S/C16H21N3O/c1-12-11-19(8-9-20-2)16(17-12)18-15-10-14(15)13-6-4-3-5-7-13/h3-7,11,14-15H,8-10H2,1-2H3,(H,17,18)
InChIKeyNWVUHMJORSFZDY-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.81
Rot. Bonds6

About 1-(2-methoxyethyl)-4-methyl-N-(2-phenylcyclopropyl)imidazol-2-amine

1-(2-methoxyethyl)-4-methyl-N-(2-phenylcyclopropyl)imidazol-2-amine (PubChem CID 106565504) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-4-methyl-N-(2-phenylcyclopropyl)imidazol-2-amine.

Molecular Properties

Compound Name1-(2-methoxyethyl)-4-methyl-N-(2-phenylcyclopropyl)imidazol-2-amine
PubChem CID106565504
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name1-(2-methoxyethyl)-4-methyl-N-(2-phenylcyclopropyl)imidazol-2-amine
SMILESCOCCn1cc(C)nc1NC1CC1c1ccccc1
InChIInChI=1S/C16H21N3O/c1-12-11-19(8-9-20-2)16(17-12)18-15-10-14(15)13-6-4-3-5-7-13/h3-7,11,14-15H,8-10H2,1-2H3,(H,17,18)
InChIKeyNWVUHMJORSFZDY-UHFFFAOYSA-N
XLogP2.81
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-4-methyl-N-(2-phenylcyclopropyl)imidazol-2-amine?
The IUPAC name of 1-(2-methoxyethyl)-4-methyl-N-(2-phenylcyclopropyl)imidazol-2-amine (CID 106565504) is 1-(2-methoxyethyl)-4-methyl-N-(2-phenylcyclopropyl)imidazol-2-amine.
What is the SMILES notation for 1-(2-methoxyethyl)-4-methyl-N-(2-phenylcyclopropyl)imidazol-2-amine?
The canonical SMILES for 1-(2-methoxyethyl)-4-methyl-N-(2-phenylcyclopropyl)imidazol-2-amine is COCCn1cc(C)nc1NC1CC1c1ccccc1.
What is the InChIKey of 1-(2-methoxyethyl)-4-methyl-N-(2-phenylcyclopropyl)imidazol-2-amine?
The InChIKey is NWVUHMJORSFZDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-12-11-19(8-9-20-2)16(17-12)18-15-10-14(15)13-6-4-3-5-7-13/h3-7,11,14-15H,8-10H2,1-2H3,(H,17,18).
What are the key properties of 1-(2-methoxyethyl)-4-methyl-N-(2-phenylcyclopropyl)imidazol-2-amine?
1-(2-methoxyethyl)-4-methyl-N-(2-phenylcyclopropyl)imidazol-2-amine has a molecular weight of 271.36 g/mol, XLogP of 2.81, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-4-methyl-N-(2-phenylcyclopropyl)imidazol-2-amine is sourced from PubChem (CID 106565504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).