9-(1-cyclopropylethyl)-8-phenyl-6,9-diazaspiro[4.5]decane

C19H28N2 — CID 64933473

IUPAC9-(1-cyclopropylethyl)-8-phenyl-6,9-diazaspiro[4.5]decane
SMILESCC(C1CC1)N1CC2(CCCC2)NCC1c1ccccc1
InChIInChI=1S/C19H28N2/c1-15(16-9-10-16)21-14-19(11-5-6-12-19)20-13-18(21)17-7-3-2-4-8-17/h2-4,7-8,15-16,18,20H,5-6,9-14H2,1H3
InChIKeyOHGIKUKSGGOLIP-UHFFFAOYSA-N
MW284.45 g/mol
LogP3.74
Rot. Bonds3

About 9-(1-cyclopropylethyl)-8-phenyl-6,9-diazaspiro[4.5]decane

9-(1-cyclopropylethyl)-8-phenyl-6,9-diazaspiro[4.5]decane (PubChem CID 64933473) has the molecular formula C19H28N2 and a molecular weight of 284.45 g/mol. Its IUPAC name is 9-(1-cyclopropylethyl)-8-phenyl-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name9-(1-cyclopropylethyl)-8-phenyl-6,9-diazaspiro[4.5]decane
PubChem CID64933473
Molecular FormulaC19H28N2
Molecular Weight284.45 g/mol
Exact Mass284.23
IUPAC Name9-(1-cyclopropylethyl)-8-phenyl-6,9-diazaspiro[4.5]decane
SMILESCC(C1CC1)N1CC2(CCCC2)NCC1c1ccccc1
InChIInChI=1S/C19H28N2/c1-15(16-9-10-16)21-14-19(11-5-6-12-19)20-13-18(21)17-7-3-2-4-8-17/h2-4,7-8,15-16,18,20H,5-6,9-14H2,1H3
InChIKeyOHGIKUKSGGOLIP-UHFFFAOYSA-N
XLogP3.74
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.45
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-(1-cyclopropylethyl)-8-phenyl-6,9-diazaspiro[4.5]decane?
The IUPAC name of 9-(1-cyclopropylethyl)-8-phenyl-6,9-diazaspiro[4.5]decane (CID 64933473) is 9-(1-cyclopropylethyl)-8-phenyl-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 9-(1-cyclopropylethyl)-8-phenyl-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 9-(1-cyclopropylethyl)-8-phenyl-6,9-diazaspiro[4.5]decane is CC(C1CC1)N1CC2(CCCC2)NCC1c1ccccc1.
What is the InChIKey of 9-(1-cyclopropylethyl)-8-phenyl-6,9-diazaspiro[4.5]decane?
The InChIKey is OHGIKUKSGGOLIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2/c1-15(16-9-10-16)21-14-19(11-5-6-12-19)20-13-18(21)17-7-3-2-4-8-17/h2-4,7-8,15-16,18,20H,5-6,9-14H2,1H3.
What are the key properties of 9-(1-cyclopropylethyl)-8-phenyl-6,9-diazaspiro[4.5]decane?
9-(1-cyclopropylethyl)-8-phenyl-6,9-diazaspiro[4.5]decane has a molecular weight of 284.45 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(1-cyclopropylethyl)-8-phenyl-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 64933473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).