spiro[5H-benzimidazolo[1,2-c]quinazoline-6,1'-cyclopentane]

C18H17N3 — CID 2999723

IUPACspiro[5H-benzimidazolo[1,2-c]quinazoline-6,1'-cyclopentane]
SMILESc1ccc2c(c1)NC1(CCCC1)n1c-2nc2ccccc21
InChIInChI=1S/C18H17N3/c1-2-8-14-13(7-1)17-19-15-9-3-4-10-16(15)21(17)18(20-14)11-5-6-12-18/h1-4,7-10,20H,5-6,11-12H2
InChIKeyFNILECIMVOQFFD-UHFFFAOYSA-N
MW275.36 g/mol
LogP4.36
Rot. Bonds

About spiro[5H-benzimidazolo[1,2-c]quinazoline-6,1'-cyclopentane]

spiro[5H-benzimidazolo[1,2-c]quinazoline-6,1'-cyclopentane] (PubChem CID 2999723) has the molecular formula C18H17N3 and a molecular weight of 275.36 g/mol. Its IUPAC name is spiro[5H-benzimidazolo[1,2-c]quinazoline-6,1'-cyclopentane].

Molecular Properties

Compound Namespiro[5H-benzimidazolo[1,2-c]quinazoline-6,1'-cyclopentane]
PubChem CID2999723
Molecular FormulaC18H17N3
Molecular Weight275.36 g/mol
Exact Mass275.14
IUPAC Namespiro[5H-benzimidazolo[1,2-c]quinazoline-6,1'-cyclopentane]
SMILESc1ccc2c(c1)NC1(CCCC1)n1c-2nc2ccccc21
InChIInChI=1S/C18H17N3/c1-2-8-14-13(7-1)17-19-15-9-3-4-10-16(15)21(17)18(20-14)11-5-6-12-18/h1-4,7-10,20H,5-6,11-12H2
InChIKeyFNILECIMVOQFFD-UHFFFAOYSA-N
XLogP4.36
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of spiro[5H-benzimidazolo[1,2-c]quinazoline-6,1'-cyclopentane]?
The IUPAC name of spiro[5H-benzimidazolo[1,2-c]quinazoline-6,1'-cyclopentane] (CID 2999723) is spiro[5H-benzimidazolo[1,2-c]quinazoline-6,1'-cyclopentane].
What is the SMILES notation for spiro[5H-benzimidazolo[1,2-c]quinazoline-6,1'-cyclopentane]?
The canonical SMILES for spiro[5H-benzimidazolo[1,2-c]quinazoline-6,1'-cyclopentane] is c1ccc2c(c1)NC1(CCCC1)n1c-2nc2ccccc21.
What is the InChIKey of spiro[5H-benzimidazolo[1,2-c]quinazoline-6,1'-cyclopentane]?
The InChIKey is FNILECIMVOQFFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3/c1-2-8-14-13(7-1)17-19-15-9-3-4-10-16(15)21(17)18(20-14)11-5-6-12-18/h1-4,7-10,20H,5-6,11-12H2.
What are the key properties of spiro[5H-benzimidazolo[1,2-c]quinazoline-6,1'-cyclopentane]?
spiro[5H-benzimidazolo[1,2-c]quinazoline-6,1'-cyclopentane] has a molecular weight of 275.36 g/mol, XLogP of 4.36, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[5H-benzimidazolo[1,2-c]quinazoline-6,1'-cyclopentane] is sourced from PubChem (CID 2999723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).