5-methyl-1-(2-morpholin-4-ylethyl)benzimidazol-2-amine

C14H20N4O — CID 43661563

IUPAC5-methyl-1-(2-morpholin-4-ylethyl)benzimidazol-2-amine
SMILESCc1ccc2c(c1)nc(N)n2CCN1CCOCC1
InChIInChI=1S/C14H20N4O/c1-11-2-3-13-12(10-11)16-14(15)18(13)5-4-17-6-8-19-9-7-17/h2-3,10H,4-9H2,1H3,(H2,15,16)
InChIKeyHISPWOCTZNTOPD-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.26
Rot. Bonds3

About 5-methyl-1-(2-morpholin-4-ylethyl)benzimidazol-2-amine

5-methyl-1-(2-morpholin-4-ylethyl)benzimidazol-2-amine (PubChem CID 43661563) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 5-methyl-1-(2-morpholin-4-ylethyl)benzimidazol-2-amine.

Molecular Properties

Compound Name5-methyl-1-(2-morpholin-4-ylethyl)benzimidazol-2-amine
PubChem CID43661563
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name5-methyl-1-(2-morpholin-4-ylethyl)benzimidazol-2-amine
SMILESCc1ccc2c(c1)nc(N)n2CCN1CCOCC1
InChIInChI=1S/C14H20N4O/c1-11-2-3-13-12(10-11)16-14(15)18(13)5-4-17-6-8-19-9-7-17/h2-3,10H,4-9H2,1H3,(H2,15,16)
InChIKeyHISPWOCTZNTOPD-UHFFFAOYSA-N
XLogP1.26
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-(2-morpholin-4-ylethyl)benzimidazol-2-amine?
The IUPAC name of 5-methyl-1-(2-morpholin-4-ylethyl)benzimidazol-2-amine (CID 43661563) is 5-methyl-1-(2-morpholin-4-ylethyl)benzimidazol-2-amine.
What is the SMILES notation for 5-methyl-1-(2-morpholin-4-ylethyl)benzimidazol-2-amine?
The canonical SMILES for 5-methyl-1-(2-morpholin-4-ylethyl)benzimidazol-2-amine is Cc1ccc2c(c1)nc(N)n2CCN1CCOCC1.
What is the InChIKey of 5-methyl-1-(2-morpholin-4-ylethyl)benzimidazol-2-amine?
The InChIKey is HISPWOCTZNTOPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-11-2-3-13-12(10-11)16-14(15)18(13)5-4-17-6-8-19-9-7-17/h2-3,10H,4-9H2,1H3,(H2,15,16).
What are the key properties of 5-methyl-1-(2-morpholin-4-ylethyl)benzimidazol-2-amine?
5-methyl-1-(2-morpholin-4-ylethyl)benzimidazol-2-amine has a molecular weight of 260.34 g/mol, XLogP of 1.26, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-(2-morpholin-4-ylethyl)benzimidazol-2-amine is sourced from PubChem (CID 43661563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).