N-ethyl-N-(1H-imidazol-2-ylmethyl)ethanamine

C8H15N3 — CID 14627457

IUPACN-ethyl-N-(1H-imidazol-2-ylmethyl)ethanamine
SMILESCCN(CC)Cc1ncc[nH]1
InChIInChI=1S/C8H15N3/c1-3-11(4-2)7-8-9-5-6-10-8/h5-6H,3-4,7H2,1-2H3,(H,9,10)
InChIKeyDHRHYUYDWNXLMG-UHFFFAOYSA-N
MW153.23 g/mol
LogP1.25
Rot. Bonds4

About N-ethyl-N-(1H-imidazol-2-ylmethyl)ethanamine

N-ethyl-N-(1H-imidazol-2-ylmethyl)ethanamine (PubChem CID 14627457) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is N-ethyl-N-(1H-imidazol-2-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-N-(1H-imidazol-2-ylmethyl)ethanamine
PubChem CID14627457
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC NameN-ethyl-N-(1H-imidazol-2-ylmethyl)ethanamine
SMILESCCN(CC)Cc1ncc[nH]1
InChIInChI=1S/C8H15N3/c1-3-11(4-2)7-8-9-5-6-10-8/h5-6H,3-4,7H2,1-2H3,(H,9,10)
InChIKeyDHRHYUYDWNXLMG-UHFFFAOYSA-N
XLogP1.25
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1H-imidazol-2-ylmethyl)-N-methylethanamine
CID 55285283
ethane;2-ethyl-1H-imidazole
CID 144736598
N-ethyl-N-(1H-imidazol-2-ylmethyl)propan-2-amine
CID 176673035
N,N-bis(1H-imidazol-2-ylmethyl)propan-2-amine
CID 59825984
bis(2-ethyl-1H-imidazole);hydrate
CID 70001211
2-ethyl-1H-imidazole;dihydroiodide
CID 175121589
2-ethyl-1H-imidazole;methanol
CID 176573862
N-(1H-imidazol-2-ylmethyl)-N,2-dimethylpropanamide
CID 63929546
tris(1H-imidazol-2-ylmethyl)-methylazanium
CID 18690534
N,N-bis[3-(1H-imidazol-2-yl)propyl]butan-1-amine
CID 140833512
2-amino-N-(1H-imidazol-2-ylmethyl)-N-methylbutanamide
CID 64517492
1-(1H-imidazol-2-ylmethyl)-1-methylthiourea
CID 64511696

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(1H-imidazol-2-ylmethyl)ethanamine?
The IUPAC name of N-ethyl-N-(1H-imidazol-2-ylmethyl)ethanamine (CID 14627457) is N-ethyl-N-(1H-imidazol-2-ylmethyl)ethanamine.
What is the SMILES notation for N-ethyl-N-(1H-imidazol-2-ylmethyl)ethanamine?
The canonical SMILES for N-ethyl-N-(1H-imidazol-2-ylmethyl)ethanamine is CCN(CC)Cc1ncc[nH]1.
What is the InChIKey of N-ethyl-N-(1H-imidazol-2-ylmethyl)ethanamine?
The InChIKey is DHRHYUYDWNXLMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-3-11(4-2)7-8-9-5-6-10-8/h5-6H,3-4,7H2,1-2H3,(H,9,10).
What are the key properties of N-ethyl-N-(1H-imidazol-2-ylmethyl)ethanamine?
N-ethyl-N-(1H-imidazol-2-ylmethyl)ethanamine has a molecular weight of 153.23 g/mol, XLogP of 1.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(1H-imidazol-2-ylmethyl)ethanamine is sourced from PubChem (CID 14627457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).