N-(3-ethylcyclohexyl)-1-(2-methoxyethyl)imidazol-2-amine

C14H25N3O — CID 106574931

IUPACN-(3-ethylcyclohexyl)-1-(2-methoxyethyl)imidazol-2-amine
SMILESCCC1CCCC(Nc2nccn2CCOC)C1
InChIInChI=1S/C14H25N3O/c1-3-12-5-4-6-13(11-12)16-14-15-7-8-17(14)9-10-18-2/h7-8,12-13H,3-6,9-11H2,1-2H3,(H,15,16)
InChIKeyRVLPZYYHZSHFPN-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.91
Rot. Bonds6

About N-(3-ethylcyclohexyl)-1-(2-methoxyethyl)imidazol-2-amine

N-(3-ethylcyclohexyl)-1-(2-methoxyethyl)imidazol-2-amine (PubChem CID 106574931) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is N-(3-ethylcyclohexyl)-1-(2-methoxyethyl)imidazol-2-amine.

Molecular Properties

Compound NameN-(3-ethylcyclohexyl)-1-(2-methoxyethyl)imidazol-2-amine
PubChem CID106574931
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC NameN-(3-ethylcyclohexyl)-1-(2-methoxyethyl)imidazol-2-amine
SMILESCCC1CCCC(Nc2nccn2CCOC)C1
InChIInChI=1S/C14H25N3O/c1-3-12-5-4-6-13(11-12)16-14-15-7-8-17(14)9-10-18-2/h7-8,12-13H,3-6,9-11H2,1-2H3,(H,15,16)
InChIKeyRVLPZYYHZSHFPN-UHFFFAOYSA-N
XLogP2.91
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-ethylcyclohexyl)-1-(2-methoxyethyl)imidazol-2-amine?
The IUPAC name of N-(3-ethylcyclohexyl)-1-(2-methoxyethyl)imidazol-2-amine (CID 106574931) is N-(3-ethylcyclohexyl)-1-(2-methoxyethyl)imidazol-2-amine.
What is the SMILES notation for N-(3-ethylcyclohexyl)-1-(2-methoxyethyl)imidazol-2-amine?
The canonical SMILES for N-(3-ethylcyclohexyl)-1-(2-methoxyethyl)imidazol-2-amine is CCC1CCCC(Nc2nccn2CCOC)C1.
What is the InChIKey of N-(3-ethylcyclohexyl)-1-(2-methoxyethyl)imidazol-2-amine?
The InChIKey is RVLPZYYHZSHFPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-3-12-5-4-6-13(11-12)16-14-15-7-8-17(14)9-10-18-2/h7-8,12-13H,3-6,9-11H2,1-2H3,(H,15,16).
What are the key properties of N-(3-ethylcyclohexyl)-1-(2-methoxyethyl)imidazol-2-amine?
N-(3-ethylcyclohexyl)-1-(2-methoxyethyl)imidazol-2-amine has a molecular weight of 251.37 g/mol, XLogP of 2.91, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylcyclohexyl)-1-(2-methoxyethyl)imidazol-2-amine is sourced from PubChem (CID 106574931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).