2-methyl-N-[[1-[2-(4-methylpiperazin-1-yl)ethyl]imidazol-2-yl]methyl]propan-2-amine

C15H29N5 — CID 82891583

IUPAC2-methyl-N-[[1-[2-(4-methylpiperazin-1-yl)ethyl]imidazol-2-yl]methyl]propan-2-amine
SMILESCN1CCN(CCn2ccnc2CNC(C)(C)C)CC1
InChIInChI=1S/C15H29N5/c1-15(2,3)17-13-14-16-5-6-20(14)12-11-19-9-7-18(4)8-10-19/h5-6,17H,7-13H2,1-4H3
InChIKeySUUXDYXLQMVBEE-UHFFFAOYSA-N
MW279.43 g/mol
LogP1.02
Rot. Bonds5

About 2-methyl-N-[[1-[2-(4-methylpiperazin-1-yl)ethyl]imidazol-2-yl]methyl]propan-2-amine

2-methyl-N-[[1-[2-(4-methylpiperazin-1-yl)ethyl]imidazol-2-yl]methyl]propan-2-amine (PubChem CID 82891583) has the molecular formula C15H29N5 and a molecular weight of 279.43 g/mol. Its IUPAC name is 2-methyl-N-[[1-[2-(4-methylpiperazin-1-yl)ethyl]imidazol-2-yl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[1-[2-(4-methylpiperazin-1-yl)ethyl]imidazol-2-yl]methyl]propan-2-amine
PubChem CID82891583
Molecular FormulaC15H29N5
Molecular Weight279.43 g/mol
Exact Mass279.24
IUPAC Name2-methyl-N-[[1-[2-(4-methylpiperazin-1-yl)ethyl]imidazol-2-yl]methyl]propan-2-amine
SMILESCN1CCN(CCn2ccnc2CNC(C)(C)C)CC1
InChIInChI=1S/C15H29N5/c1-15(2,3)17-13-14-16-5-6-20(14)12-11-19-9-7-18(4)8-10-19/h5-6,17H,7-13H2,1-4H3
InChIKeySUUXDYXLQMVBEE-UHFFFAOYSA-N
XLogP1.02
TPSA36.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1-ethylimidazol-2-yl)methyl]-2-(4-methylpiperazin-1-yl)ethanamine
CID 62351528
N-[[1-(2-ethoxyethyl)imidazol-2-yl]methyl]-2-methylpropan-2-amine
CID 62222189
2-methyl-N-[[1-(4,4,4-trifluorobutyl)imidazol-2-yl]methyl]propan-2-amine
CID 113326667
N-[[1-[2-(diethylamino)ethyl]imidazol-2-yl]methyl]-2-methylpropan-2-amine
CID 62221842
4-[2-[(tert-butylamino)methyl]imidazol-1-yl]butanenitrile
CID 62221300
N-[[1-(cyclopentylmethyl)imidazol-2-yl]methyl]-2-methylpropan-2-amine
CID 55048482
N-[[1-(3-ethylsulfonylpropyl)imidazol-2-yl]methyl]-2-methylpropan-2-amine
CID 65097886
3-methyl-N-[(1-propylimidazol-2-yl)methyl]pentan-3-amine
CID 106328036
2-methyl-N-[[1-(3-phenylpropyl)imidazol-2-yl]methyl]propan-2-amine
CID 62221649
N-[[1-(ethoxymethyl)imidazol-2-yl]methyl]-2-methylpropan-2-amine
CID 65369489
2-methyl-N-[[1-[2-(3-methylbutoxy)ethyl]imidazol-2-yl]methyl]propan-2-amine
CID 62222724
3-[2-[(tert-butylamino)methyl]imidazol-1-yl]-N-ethylpropanamide
CID 62325908

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[1-[2-(4-methylpiperazin-1-yl)ethyl]imidazol-2-yl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[1-[2-(4-methylpiperazin-1-yl)ethyl]imidazol-2-yl]methyl]propan-2-amine (CID 82891583) is 2-methyl-N-[[1-[2-(4-methylpiperazin-1-yl)ethyl]imidazol-2-yl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[1-[2-(4-methylpiperazin-1-yl)ethyl]imidazol-2-yl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[1-[2-(4-methylpiperazin-1-yl)ethyl]imidazol-2-yl]methyl]propan-2-amine is CN1CCN(CCn2ccnc2CNC(C)(C)C)CC1.
What is the InChIKey of 2-methyl-N-[[1-[2-(4-methylpiperazin-1-yl)ethyl]imidazol-2-yl]methyl]propan-2-amine?
The InChIKey is SUUXDYXLQMVBEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N5/c1-15(2,3)17-13-14-16-5-6-20(14)12-11-19-9-7-18(4)8-10-19/h5-6,17H,7-13H2,1-4H3.
What are the key properties of 2-methyl-N-[[1-[2-(4-methylpiperazin-1-yl)ethyl]imidazol-2-yl]methyl]propan-2-amine?
2-methyl-N-[[1-[2-(4-methylpiperazin-1-yl)ethyl]imidazol-2-yl]methyl]propan-2-amine has a molecular weight of 279.43 g/mol, XLogP of 1.02, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[1-[2-(4-methylpiperazin-1-yl)ethyl]imidazol-2-yl]methyl]propan-2-amine is sourced from PubChem (CID 82891583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).