N-[(4-ethyl-5-methyl-1H-imidazol-2-yl)methyl]cyclopropanamine

C10H17N3 — CID 82237973

IUPACN-[(4-ethyl-5-methyl-1H-imidazol-2-yl)methyl]cyclopropanamine
SMILESCCc1nc(CNC2CC2)[nH]c1C
InChIInChI=1S/C10H17N3/c1-3-9-7(2)12-10(13-9)6-11-8-4-5-8/h8,11H,3-6H2,1-2H3,(H,12,13)
InChIKeyDKDVDDDEKVLILI-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.53
Rot. Bonds4

About N-[(4-ethyl-5-methyl-1H-imidazol-2-yl)methyl]cyclopropanamine

N-[(4-ethyl-5-methyl-1H-imidazol-2-yl)methyl]cyclopropanamine (PubChem CID 82237973) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is N-[(4-ethyl-5-methyl-1H-imidazol-2-yl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(4-ethyl-5-methyl-1H-imidazol-2-yl)methyl]cyclopropanamine
PubChem CID82237973
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC NameN-[(4-ethyl-5-methyl-1H-imidazol-2-yl)methyl]cyclopropanamine
SMILESCCc1nc(CNC2CC2)[nH]c1C
InChIInChI=1S/C10H17N3/c1-3-9-7(2)12-10(13-9)6-11-8-4-5-8/h8,11H,3-6H2,1-2H3,(H,12,13)
InChIKeyDKDVDDDEKVLILI-UHFFFAOYSA-N
XLogP1.53
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(5-ethyl-1H-imidazol-2-yl)methyl]cyclopropanamine
CID 82239451
2-cyclopropyl-4-ethyl-5-methyl-1H-imidazole
CID 123293833
3-[(4-ethyl-5-methyl-1H-imidazol-2-yl)methyl]piperidine
CID 105461179
1-[3-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methylamino]piperidin-1-yl]-2-methylpropan-1-one
CID 131945464
N-[(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methyl]cyclopropanamine
CID 79795782
(2R)-2-(cyclopentylmethyl)-N-[(4-ethyl-5-methyl-1H-imidazol-2-yl)methyl]-3-[formyl(hydroxy)amino]propanamide
CID 142142753
N-[[5-methyl-4-(3-nitrophenyl)-1H-imidazol-2-yl]methyl]cyclopropanamine
CID 60841957
2-[(cyclopropylamino)methyl]-4-hydroxy-5-(4-methylphenyl)-1H-pyrimidin-6-one
CID 79441693
N-[(4-ethyl-2-methyl-1,3-thiazol-5-yl)methyl]cyclopentanamine
CID 82428112
N-[(3-methoxy-6-methyl-2-pyridinyl)methyl]cyclopropanamine
CID 79156389
2-ethyl-5-methyl-4-(pyrrolidin-3-ylmethyl)-1H-imidazole
CID 105447590
(1R,2R,3R,5R)-N-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-2,6,6-trimethylbicyclo[3.1.1]heptan-3-amine
CID 71569282

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethyl-5-methyl-1H-imidazol-2-yl)methyl]cyclopropanamine?
The IUPAC name of N-[(4-ethyl-5-methyl-1H-imidazol-2-yl)methyl]cyclopropanamine (CID 82237973) is N-[(4-ethyl-5-methyl-1H-imidazol-2-yl)methyl]cyclopropanamine.
What is the SMILES notation for N-[(4-ethyl-5-methyl-1H-imidazol-2-yl)methyl]cyclopropanamine?
The canonical SMILES for N-[(4-ethyl-5-methyl-1H-imidazol-2-yl)methyl]cyclopropanamine is CCc1nc(CNC2CC2)[nH]c1C.
What is the InChIKey of N-[(4-ethyl-5-methyl-1H-imidazol-2-yl)methyl]cyclopropanamine?
The InChIKey is DKDVDDDEKVLILI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-3-9-7(2)12-10(13-9)6-11-8-4-5-8/h8,11H,3-6H2,1-2H3,(H,12,13).
What are the key properties of N-[(4-ethyl-5-methyl-1H-imidazol-2-yl)methyl]cyclopropanamine?
N-[(4-ethyl-5-methyl-1H-imidazol-2-yl)methyl]cyclopropanamine has a molecular weight of 179.27 g/mol, XLogP of 1.53, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethyl-5-methyl-1H-imidazol-2-yl)methyl]cyclopropanamine is sourced from PubChem (CID 82237973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).