N-methyl-2-[1-(2-pyridin-4-ylethyl)imidazol-4-yl]ethanamine

C13H18N4 — CID 79985908

IUPACN-methyl-2-[1-(2-pyridin-4-ylethyl)imidazol-4-yl]ethanamine
SMILESCNCCc1cn(CCc2ccncc2)cn1
InChIInChI=1S/C13H18N4/c1-14-6-4-13-10-17(11-16-13)9-5-12-2-7-15-8-3-12/h2-3,7-8,10-11,14H,4-6,9H2,1H3
InChIKeySUVKPCYHCQRTLI-UHFFFAOYSA-N
MW230.31 g/mol
LogP1.28
Rot. Bonds6

About N-methyl-2-[1-(2-pyridin-4-ylethyl)imidazol-4-yl]ethanamine

N-methyl-2-[1-(2-pyridin-4-ylethyl)imidazol-4-yl]ethanamine (PubChem CID 79985908) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is N-methyl-2-[1-(2-pyridin-4-ylethyl)imidazol-4-yl]ethanamine.

Molecular Properties

Compound NameN-methyl-2-[1-(2-pyridin-4-ylethyl)imidazol-4-yl]ethanamine
PubChem CID79985908
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC NameN-methyl-2-[1-(2-pyridin-4-ylethyl)imidazol-4-yl]ethanamine
SMILESCNCCc1cn(CCc2ccncc2)cn1
InChIInChI=1S/C13H18N4/c1-14-6-4-13-10-17(11-16-13)9-5-12-2-7-15-8-3-12/h2-3,7-8,10-11,14H,4-6,9H2,1H3
InChIKeySUVKPCYHCQRTLI-UHFFFAOYSA-N
XLogP1.28
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-[1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-4-yl]ethanamine
CID 103014178
2-methoxy-N-[[1-(2-pyridin-4-ylethyl)imidazol-4-yl]methyl]ethanamine
CID 106720576
N-methyl-2-[1-(3-methylbutyl)imidazol-4-yl]ethanamine
CID 79985899
4-[4-[2-(methylamino)ethyl]imidazol-1-yl]butan-1-ol
CID 79985168
N-ethyl-2-[1-(2-phenylethyl)imidazol-4-yl]ethanamine
CID 79985012
N-methyl-2-[1-[(4-methylphenyl)methyl]imidazol-4-yl]ethanamine
CID 79985488
N-methyl-2-[1-(2-propan-2-yloxyethyl)imidazol-4-yl]ethanamine
CID 79985732
N-methyl-2-[1-[[4-(trifluoromethyl)phenyl]methyl]imidazol-4-yl]ethanamine
CID 79985317
4-benzyl-1-(2-phenylethyl)imidazole
CID 23368311
N-methyl-2-[1-[(3-methyl-2-pyridinyl)methyl]imidazol-4-yl]ethanamine
CID 112651274
2-[1-[(5-bromo-3-pyridinyl)methyl]imidazol-4-yl]-N-methylethanamine
CID 113455792
2-[1-[2-(4-methoxyphenyl)ethyl]imidazol-4-yl]ethanamine
CID 79982447

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[1-(2-pyridin-4-ylethyl)imidazol-4-yl]ethanamine?
The IUPAC name of N-methyl-2-[1-(2-pyridin-4-ylethyl)imidazol-4-yl]ethanamine (CID 79985908) is N-methyl-2-[1-(2-pyridin-4-ylethyl)imidazol-4-yl]ethanamine.
What is the SMILES notation for N-methyl-2-[1-(2-pyridin-4-ylethyl)imidazol-4-yl]ethanamine?
The canonical SMILES for N-methyl-2-[1-(2-pyridin-4-ylethyl)imidazol-4-yl]ethanamine is CNCCc1cn(CCc2ccncc2)cn1.
What is the InChIKey of N-methyl-2-[1-(2-pyridin-4-ylethyl)imidazol-4-yl]ethanamine?
The InChIKey is SUVKPCYHCQRTLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-14-6-4-13-10-17(11-16-13)9-5-12-2-7-15-8-3-12/h2-3,7-8,10-11,14H,4-6,9H2,1H3.
What are the key properties of N-methyl-2-[1-(2-pyridin-4-ylethyl)imidazol-4-yl]ethanamine?
N-methyl-2-[1-(2-pyridin-4-ylethyl)imidazol-4-yl]ethanamine has a molecular weight of 230.31 g/mol, XLogP of 1.28, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[1-(2-pyridin-4-ylethyl)imidazol-4-yl]ethanamine is sourced from PubChem (CID 79985908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).