8-butan-2-yl-6-(cyclobutylmethyl)-6,9-diazaspiro[4.5]decane

C17H32N2 — CID 65462680

IUPAC8-butan-2-yl-6-(cyclobutylmethyl)-6,9-diazaspiro[4.5]decane
SMILESCCC(C)C1CN(CC2CCC2)C2(CCCC2)CN1
InChIInChI=1S/C17H32N2/c1-3-14(2)16-12-19(11-15-7-6-8-15)17(13-18-16)9-4-5-10-17/h14-16,18H,3-13H2,1-2H3
InChIKeyQNVQITWKNDEFNO-UHFFFAOYSA-N
MW264.46 g/mol
LogP3.42
Rot. Bonds4

About 8-butan-2-yl-6-(cyclobutylmethyl)-6,9-diazaspiro[4.5]decane

8-butan-2-yl-6-(cyclobutylmethyl)-6,9-diazaspiro[4.5]decane (PubChem CID 65462680) has the molecular formula C17H32N2 and a molecular weight of 264.46 g/mol. Its IUPAC name is 8-butan-2-yl-6-(cyclobutylmethyl)-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8-butan-2-yl-6-(cyclobutylmethyl)-6,9-diazaspiro[4.5]decane
PubChem CID65462680
Molecular FormulaC17H32N2
Molecular Weight264.46 g/mol
Exact Mass264.26
IUPAC Name8-butan-2-yl-6-(cyclobutylmethyl)-6,9-diazaspiro[4.5]decane
SMILESCCC(C)C1CN(CC2CCC2)C2(CCCC2)CN1
InChIInChI=1S/C17H32N2/c1-3-14(2)16-12-19(11-15-7-6-8-15)17(13-18-16)9-4-5-10-17/h14-16,18H,3-13H2,1-2H3
InChIKeyQNVQITWKNDEFNO-UHFFFAOYSA-N
XLogP3.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.46
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cyclobutylmethyl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane
CID 65461470
5-butan-2-yl-1-(cyclobutylmethyl)-2-ethyl-2-methylpiperazine
CID 65462478
3-butan-2-yl-1-(2-fluoroethyl)-1,4-diazaspiro[5.5]undecane
CID 80696604
8-butan-2-yl-6-[(E)-but-2-enyl]-6,9-diazaspiro[4.5]decane
CID 107898013
8-butan-2-yl-6-(2-propan-2-yloxyethyl)-6,9-diazaspiro[4.5]decane
CID 64850001
3-butan-2-yl-1-hexyl-1,4-diazaspiro[5.5]undecane
CID 64848074
1-(cyclobutylmethyl)-3-propyl-1,4-diazaspiro[5.5]undecane
CID 65460666
5-butan-2-yl-1-(cyclopropylmethyl)-2-ethyl-2-methylpiperazine
CID 64849416
1-ethyl-3-propan-2-yl-1,4-diazaspiro[5.5]undecane
CID 64839273
8-propan-2-yl-6-propyl-6,9-diazaspiro[4.5]decane
CID 64839855
3-ethyl-1-(oxan-4-ylmethyl)-1,4-diazaspiro[5.5]undecane
CID 64843741
5-butan-2-yl-2-cyclopropyl-1-ethyl-2-methylpiperazine
CID 64849041

Frequently Asked Questions

What is the IUPAC name of 8-butan-2-yl-6-(cyclobutylmethyl)-6,9-diazaspiro[4.5]decane?
The IUPAC name of 8-butan-2-yl-6-(cyclobutylmethyl)-6,9-diazaspiro[4.5]decane (CID 65462680) is 8-butan-2-yl-6-(cyclobutylmethyl)-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 8-butan-2-yl-6-(cyclobutylmethyl)-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 8-butan-2-yl-6-(cyclobutylmethyl)-6,9-diazaspiro[4.5]decane is CCC(C)C1CN(CC2CCC2)C2(CCCC2)CN1.
What is the InChIKey of 8-butan-2-yl-6-(cyclobutylmethyl)-6,9-diazaspiro[4.5]decane?
The InChIKey is QNVQITWKNDEFNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2/c1-3-14(2)16-12-19(11-15-7-6-8-15)17(13-18-16)9-4-5-10-17/h14-16,18H,3-13H2,1-2H3.
What are the key properties of 8-butan-2-yl-6-(cyclobutylmethyl)-6,9-diazaspiro[4.5]decane?
8-butan-2-yl-6-(cyclobutylmethyl)-6,9-diazaspiro[4.5]decane has a molecular weight of 264.46 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-butan-2-yl-6-(cyclobutylmethyl)-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 65462680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).