N-(3-ethoxycyclobutyl)-4,5-dihydro-1H-imidazol-2-amine

C9H17N3O — CID 105413100

IUPACN-(3-ethoxycyclobutyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCCOC1CC(NC2=NCCN2)C1
InChIInChI=1S/C9H17N3O/c1-2-13-8-5-7(6-8)12-9-10-3-4-11-9/h7-8H,2-6H2,1H3,(H2,10,11,12)
InChIKeyDUCPBQHHYDVHPG-UHFFFAOYSA-N
MW183.25 g/mol
LogP0.10
Rot. Bonds3

About N-(3-ethoxycyclobutyl)-4,5-dihydro-1H-imidazol-2-amine

N-(3-ethoxycyclobutyl)-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 105413100) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is N-(3-ethoxycyclobutyl)-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-(3-ethoxycyclobutyl)-4,5-dihydro-1H-imidazol-2-amine
PubChem CID105413100
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC NameN-(3-ethoxycyclobutyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCCOC1CC(NC2=NCCN2)C1
InChIInChI=1S/C9H17N3O/c1-2-13-8-5-7(6-8)12-9-10-3-4-11-9/h7-8H,2-6H2,1H3,(H2,10,11,12)
InChIKeyDUCPBQHHYDVHPG-UHFFFAOYSA-N
XLogP0.10
TPSA45.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-N-(4,5-dihydro-1H-imidazol-2-yl)cyclobutane-1,3-diamine
CID 114401708
N-(3-ethoxycyclobutyl)-5-methyl-1,3,4-thiadiazol-2-amine
CID 102609219
N-(3-ethoxyspiro[3.4]octan-1-yl)-1,4,5,6-tetrahydropyrimidin-2-amine
CID 111757516
N-(1,1-dioxothiolan-3-yl)-4,5-dihydro-1H-imidazol-2-amine
CID 115601230
3-ethoxy-N-methylcyclopentan-1-amine
CID 79642997
N-(3-ethoxycyclobutyl)-5-ethyl-1,3,4-thiadiazol-2-amine
CID 107647717
N-hexyl-4,5-dihydro-1H-imidazol-2-amine
CID 71402010
N-(3-ethoxycyclobutyl)-8-methylquinolin-5-amine
CID 112573902
N-(3-ethoxycyclobutyl)-2-pyrrolidin-1-ylpyridin-3-amine
CID 112568481
N-(3-ethoxycyclobutyl)quinolin-6-amine
CID 112573906
N-(3-ethoxycyclobutyl)-3-methylsulfonylpyridin-2-amine
CID 106545829
1-N-(3-ethoxycyclobutyl)-4-N,4-N,2-trimethylbenzene-1,4-diamine
CID 112561855

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxycyclobutyl)-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of N-(3-ethoxycyclobutyl)-4,5-dihydro-1H-imidazol-2-amine (CID 105413100) is N-(3-ethoxycyclobutyl)-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for N-(3-ethoxycyclobutyl)-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for N-(3-ethoxycyclobutyl)-4,5-dihydro-1H-imidazol-2-amine is CCOC1CC(NC2=NCCN2)C1.
What is the InChIKey of N-(3-ethoxycyclobutyl)-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is DUCPBQHHYDVHPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c1-2-13-8-5-7(6-8)12-9-10-3-4-11-9/h7-8H,2-6H2,1H3,(H2,10,11,12).
What are the key properties of N-(3-ethoxycyclobutyl)-4,5-dihydro-1H-imidazol-2-amine?
N-(3-ethoxycyclobutyl)-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 183.25 g/mol, XLogP of 0.10, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxycyclobutyl)-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 105413100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).