N-[(1-ethyl-5-methylimidazol-2-yl)methyl]cyclopropanamine

C10H17N3 — CID 117188466

IUPACN-[(1-ethyl-5-methylimidazol-2-yl)methyl]cyclopropanamine
SMILESCCn1c(C)cnc1CNC1CC1
InChIInChI=1S/C10H17N3/c1-3-13-8(2)6-12-10(13)7-11-9-4-5-9/h6,9,11H,3-5,7H2,1-2H3
InChIKeyDZKZAIFACKCOAV-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.46
Rot. Bonds4

About N-[(1-ethyl-5-methylimidazol-2-yl)methyl]cyclopropanamine

N-[(1-ethyl-5-methylimidazol-2-yl)methyl]cyclopropanamine (PubChem CID 117188466) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is N-[(1-ethyl-5-methylimidazol-2-yl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(1-ethyl-5-methylimidazol-2-yl)methyl]cyclopropanamine
PubChem CID117188466
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC NameN-[(1-ethyl-5-methylimidazol-2-yl)methyl]cyclopropanamine
SMILESCCn1c(C)cnc1CNC1CC1
InChIInChI=1S/C10H17N3/c1-3-13-8(2)6-12-10(13)7-11-9-4-5-9/h6,9,11H,3-5,7H2,1-2H3
InChIKeyDZKZAIFACKCOAV-UHFFFAOYSA-N
XLogP1.46
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-methyl-2-pyridinyl)methyl]cyclopropanamine
CID 80708604
N-(imidazo[1,5-a]pyridin-3-ylmethyl)cyclopropanamine
CID 116993073
N-[[2-(methylsulfanylmethyl)pyrimidin-5-yl]methyl]cyclopropanamine
CID 62757142
N-[(2-tert-butyl-1,2,4-triazol-3-yl)methyl]cyclopropanamine
CID 107447429
N-[(2-ethyl-1,2,4-triazol-3-yl)methyl]-4-methylsulfanylcyclohexan-1-amine
CID 114123294
N-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-propylpiperidin-4-amine
CID 60695637
N-[(1-ethyl-6-fluorobenzimidazol-2-yl)methyl]cyclopentanamine
CID 55068076
4-ethyl-N-[(1-methylimidazol-2-yl)methyl]cyclohexan-1-amine
CID 61470208
N-[[4-(3,5-dimethylpyrazol-1-yl)-6-methyl-3-pyridinyl]methyl]cyclopropanamine
CID 81254175
N-[(2-methyl-1,3-oxazol-5-yl)methyl]cyclopropanamine
CID 117192172
N-[(6-methyl-3-pyridinyl)methyl]cyclopropanamine
CID 43163855
N-[(5-methyl-1,3-thiazol-2-yl)methyl]cyclopropanamine;dihydrochloride
CID 56773659

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethyl-5-methylimidazol-2-yl)methyl]cyclopropanamine?
The IUPAC name of N-[(1-ethyl-5-methylimidazol-2-yl)methyl]cyclopropanamine (CID 117188466) is N-[(1-ethyl-5-methylimidazol-2-yl)methyl]cyclopropanamine.
What is the SMILES notation for N-[(1-ethyl-5-methylimidazol-2-yl)methyl]cyclopropanamine?
The canonical SMILES for N-[(1-ethyl-5-methylimidazol-2-yl)methyl]cyclopropanamine is CCn1c(C)cnc1CNC1CC1.
What is the InChIKey of N-[(1-ethyl-5-methylimidazol-2-yl)methyl]cyclopropanamine?
The InChIKey is DZKZAIFACKCOAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-3-13-8(2)6-12-10(13)7-11-9-4-5-9/h6,9,11H,3-5,7H2,1-2H3.
What are the key properties of N-[(1-ethyl-5-methylimidazol-2-yl)methyl]cyclopropanamine?
N-[(1-ethyl-5-methylimidazol-2-yl)methyl]cyclopropanamine has a molecular weight of 179.27 g/mol, XLogP of 1.46, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethyl-5-methylimidazol-2-yl)methyl]cyclopropanamine is sourced from PubChem (CID 117188466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).