N-cyclopropyl-1-[2-(oxolan-2-yl)ethyl]imidazol-2-amine

C12H19N3O — CID 106567497

IUPACN-cyclopropyl-1-[2-(oxolan-2-yl)ethyl]imidazol-2-amine
SMILESc1cn(CCC2CCCO2)c(NC2CC2)n1
InChIInChI=1S/C12H19N3O/c1-2-11(16-9-1)5-7-15-8-6-13-12(15)14-10-3-4-10/h6,8,10-11H,1-5,7,9H2,(H,13,14)
InChIKeyIYZYWZCDDIRCNN-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.03
Rot. Bonds5

About N-cyclopropyl-1-[2-(oxolan-2-yl)ethyl]imidazol-2-amine

N-cyclopropyl-1-[2-(oxolan-2-yl)ethyl]imidazol-2-amine (PubChem CID 106567497) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N-cyclopropyl-1-[2-(oxolan-2-yl)ethyl]imidazol-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-1-[2-(oxolan-2-yl)ethyl]imidazol-2-amine
PubChem CID106567497
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN-cyclopropyl-1-[2-(oxolan-2-yl)ethyl]imidazol-2-amine
SMILESc1cn(CCC2CCCO2)c(NC2CC2)n1
InChIInChI=1S/C12H19N3O/c1-2-11(16-9-1)5-7-15-8-6-13-12(15)14-10-3-4-10/h6,8,10-11H,1-5,7,9H2,(H,13,14)
InChIKeyIYZYWZCDDIRCNN-UHFFFAOYSA-N
XLogP2.03
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-1-(oxolan-2-ylmethyl)imidazol-2-amine
CID 106560113
N-[[1-[2-(oxolan-2-yl)ethyl]imidazol-2-yl]methyl]cyclopropanamine
CID 65162327
N-(3-methoxypropyl)-1-[2-(oxolan-2-yl)ethyl]imidazol-2-amine
CID 106567498
N-[2-(oxolan-2-yl)ethyl]-1-prop-2-enylimidazol-2-amine
CID 106567466
N-[[1-[3-(oxolan-2-yl)propyl]imidazol-2-yl]methyl]cyclopropanamine
CID 65162326
N-cyclopropyl-1-pentylimidazol-2-amine
CID 106556933
N-cyclohexyl-1-[2-(3-methylcyclohexyl)ethyl]imidazol-2-amine
CID 106574374
N-cyclohexyl-1-(cyclohexylmethyl)imidazol-2-amine
CID 106561648
N-(3-methylcyclopentyl)-1-propylimidazol-2-amine
CID 106581825
1-propyl-N-(thian-4-yl)imidazol-2-amine
CID 106582117
2-(4-chlorophenyl)-1-[2-(oxan-2-yl)ethyl]imidazole
CID 56865531
N-[(1-methylimidazol-2-yl)methyl]-2-(oxolan-2-yl)ethanamine
CID 61039260

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-[2-(oxolan-2-yl)ethyl]imidazol-2-amine?
The IUPAC name of N-cyclopropyl-1-[2-(oxolan-2-yl)ethyl]imidazol-2-amine (CID 106567497) is N-cyclopropyl-1-[2-(oxolan-2-yl)ethyl]imidazol-2-amine.
What is the SMILES notation for N-cyclopropyl-1-[2-(oxolan-2-yl)ethyl]imidazol-2-amine?
The canonical SMILES for N-cyclopropyl-1-[2-(oxolan-2-yl)ethyl]imidazol-2-amine is c1cn(CCC2CCCO2)c(NC2CC2)n1.
What is the InChIKey of N-cyclopropyl-1-[2-(oxolan-2-yl)ethyl]imidazol-2-amine?
The InChIKey is IYZYWZCDDIRCNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-2-11(16-9-1)5-7-15-8-6-13-12(15)14-10-3-4-10/h6,8,10-11H,1-5,7,9H2,(H,13,14).
What are the key properties of N-cyclopropyl-1-[2-(oxolan-2-yl)ethyl]imidazol-2-amine?
N-cyclopropyl-1-[2-(oxolan-2-yl)ethyl]imidazol-2-amine has a molecular weight of 221.30 g/mol, XLogP of 2.03, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-[2-(oxolan-2-yl)ethyl]imidazol-2-amine is sourced from PubChem (CID 106567497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).