N-methyl-2-(2-methylimidazol-1-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine

C12H22N4 — CID 106614105

IUPACN-methyl-2-(2-methylimidazol-1-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine
SMILESCc1nccn1CCN(C)CC1CCCN1
InChIInChI=1S/C12H22N4/c1-11-13-6-7-16(11)9-8-15(2)10-12-4-3-5-14-12/h6-7,12,14H,3-5,8-10H2,1-2H3
InChIKeyDTMCLAPTMXZLLF-UHFFFAOYSA-N
MW222.34 g/mol
LogP0.88
Rot. Bonds5

About N-methyl-2-(2-methylimidazol-1-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine

N-methyl-2-(2-methylimidazol-1-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine (PubChem CID 106614105) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is N-methyl-2-(2-methylimidazol-1-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-(2-methylimidazol-1-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine
PubChem CID106614105
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC NameN-methyl-2-(2-methylimidazol-1-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine
SMILESCc1nccn1CCN(C)CC1CCCN1
InChIInChI=1S/C12H22N4/c1-11-13-6-7-16(11)9-8-15(2)10-12-4-3-5-14-12/h6-7,12,14H,3-5,8-10H2,1-2H3
InChIKeyDTMCLAPTMXZLLF-UHFFFAOYSA-N
XLogP0.88
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.34
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-2-(2-methylimidazol-1-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-[(2R)-pyrrolidin-2-yl]methanamine
CID 94939254
N-methyl-2-(1-methylimidazol-2-yl)-N-(piperidin-2-ylmethyl)ethanamine
CID 106635225
2-[2-[2-(2-methylimidazol-1-yl)ethoxy]ethyl]piperidine
CID 62342019
N-methyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-2-amine
CID 71641999
N-ethyl-2-(2-methylimidazol-1-yl)-N-(piperidin-3-ylmethyl)ethanamine
CID 106639131
N-methyl-2-pyridin-2-yl-N-[[(2R)-pyrrolidin-2-yl]methyl]ethanamine
CID 28599662
N-(2-chloroethyl)-N-[2-(2-methylimidazol-1-yl)ethyl]cyclobutanamine
CID 102861371
N-ethyl-N-[2-(2-methylimidazol-1-yl)ethyl]piperidin-4-amine
CID 54961313
2-[(1-methylimidazol-2-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol
CID 106621365
N-methyl-N-(piperidin-2-ylmethyl)-2-pyrrolidin-1-ylethanamine
CID 63207373
N-(cyclopropylmethyl)-1-ethyl-N-(pyrrolidin-2-ylmethyl)imidazol-2-amine
CID 106619952
2-[methyl-[2-(2-methylimidazol-1-yl)ethyl]amino]acetic acid
CID 61493400

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2-methylimidazol-1-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine?
The IUPAC name of N-methyl-2-(2-methylimidazol-1-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine (CID 106614105) is N-methyl-2-(2-methylimidazol-1-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine.
What is the SMILES notation for N-methyl-2-(2-methylimidazol-1-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine?
The canonical SMILES for N-methyl-2-(2-methylimidazol-1-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine is Cc1nccn1CCN(C)CC1CCCN1.
What is the InChIKey of N-methyl-2-(2-methylimidazol-1-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine?
The InChIKey is DTMCLAPTMXZLLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-11-13-6-7-16(11)9-8-15(2)10-12-4-3-5-14-12/h6-7,12,14H,3-5,8-10H2,1-2H3.
What are the key properties of N-methyl-2-(2-methylimidazol-1-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine?
N-methyl-2-(2-methylimidazol-1-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine has a molecular weight of 222.34 g/mol, XLogP of 0.88, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2-methylimidazol-1-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine is sourced from PubChem (CID 106614105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).