N-[(2,2-diphenylcyclopropyl)methyl]-N-methyl-2-(2-methylimidazol-1-yl)ethanamine

C23H27N3 — CID 74241273

IUPACN-[(2,2-diphenylcyclopropyl)methyl]-N-methyl-2-(2-methylimidazol-1-yl)ethanamine
SMILESCc1nccn1CCN(C)CC1CC1(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H27N3/c1-19-24-13-14-26(19)16-15-25(2)18-22-17-23(22,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-14,22H,15-18H2,1-2H3
InChIKeyFSHQETYHOUTJFD-UHFFFAOYSA-N
MW345.49 g/mol
LogP4.13
Rot. Bonds7

About N-[(2,2-diphenylcyclopropyl)methyl]-N-methyl-2-(2-methylimidazol-1-yl)ethanamine

N-[(2,2-diphenylcyclopropyl)methyl]-N-methyl-2-(2-methylimidazol-1-yl)ethanamine (PubChem CID 74241273) has the molecular formula C23H27N3 and a molecular weight of 345.49 g/mol. Its IUPAC name is N-[(2,2-diphenylcyclopropyl)methyl]-N-methyl-2-(2-methylimidazol-1-yl)ethanamine.

Molecular Properties

Compound NameN-[(2,2-diphenylcyclopropyl)methyl]-N-methyl-2-(2-methylimidazol-1-yl)ethanamine
PubChem CID74241273
Molecular FormulaC23H27N3
Molecular Weight345.49 g/mol
Exact Mass345.22
IUPAC NameN-[(2,2-diphenylcyclopropyl)methyl]-N-methyl-2-(2-methylimidazol-1-yl)ethanamine
SMILESCc1nccn1CCN(C)CC1CC1(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H27N3/c1-19-24-13-14-26(19)16-15-25(2)18-22-17-23(22,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-14,22H,15-18H2,1-2H3
InChIKeyFSHQETYHOUTJFD-UHFFFAOYSA-N
XLogP4.13
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.49
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-(2-methylimidazol-1-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 106614105
2-[methyl-[2-(2-methylimidazol-1-yl)ethyl]amino]acetic acid
CID 61493400
1-N-methyl-1-N-[2-(2-methylimidazol-1-yl)ethyl]propane-1,2-diamine
CID 63759365
(1R)-N-methyl-N-[3-(2-methylimidazol-1-yl)propyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 124614462
N-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-(2-methylimidazol-1-yl)propanamide
CID 91782036
4-[[methyl-[2-(2-methylimidazol-1-yl)ethyl]amino]methyl]oxan-4-ol
CID 114952881
N,3-dimethyl-N-[3-(2-methylimidazol-1-yl)propyl]quinoxalin-2-amine
CID 133398160
N-methyl-2-(2-methylimidazol-1-yl)-N-[[3-(trifluoromethyl)phenyl]methyl]ethanamine
CID 74238312
3-[2-(2-methylimidazol-1-yl)ethyl]-5,5-diphenylimidazolidine-2,4-dione
CID 75399916
3-[methyl-[2-(2-methylimidazol-1-yl)ethyl]amino]propanimidamide
CID 61493494
N-(2-chloroethyl)-N-[2-(2-methylimidazol-1-yl)ethyl]cyclobutanamine
CID 102861371
1-benzyl-2-methylimidazole
CID 158634472

Frequently Asked Questions

What is the IUPAC name of N-[(2,2-diphenylcyclopropyl)methyl]-N-methyl-2-(2-methylimidazol-1-yl)ethanamine?
The IUPAC name of N-[(2,2-diphenylcyclopropyl)methyl]-N-methyl-2-(2-methylimidazol-1-yl)ethanamine (CID 74241273) is N-[(2,2-diphenylcyclopropyl)methyl]-N-methyl-2-(2-methylimidazol-1-yl)ethanamine.
What is the SMILES notation for N-[(2,2-diphenylcyclopropyl)methyl]-N-methyl-2-(2-methylimidazol-1-yl)ethanamine?
The canonical SMILES for N-[(2,2-diphenylcyclopropyl)methyl]-N-methyl-2-(2-methylimidazol-1-yl)ethanamine is Cc1nccn1CCN(C)CC1CC1(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[(2,2-diphenylcyclopropyl)methyl]-N-methyl-2-(2-methylimidazol-1-yl)ethanamine?
The InChIKey is FSHQETYHOUTJFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N3/c1-19-24-13-14-26(19)16-15-25(2)18-22-17-23(22,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-14,22H,15-18H2,1-2H3.
What are the key properties of N-[(2,2-diphenylcyclopropyl)methyl]-N-methyl-2-(2-methylimidazol-1-yl)ethanamine?
N-[(2,2-diphenylcyclopropyl)methyl]-N-methyl-2-(2-methylimidazol-1-yl)ethanamine has a molecular weight of 345.49 g/mol, XLogP of 4.13, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,2-diphenylcyclopropyl)methyl]-N-methyl-2-(2-methylimidazol-1-yl)ethanamine is sourced from PubChem (CID 74241273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).