N'-(6-oxaspiro[4.5]decan-9-yl)-N'-propylpropane-1,3-diamine

C15H30N2O — CID 79904792

IUPACN'-(6-oxaspiro[4.5]decan-9-yl)-N'-propylpropane-1,3-diamine
SMILESCCCN(CCCN)C1CCOC2(CCCC2)C1
InChIInChI=1S/C15H30N2O/c1-2-10-17(11-5-9-16)14-6-12-18-15(13-14)7-3-4-8-15/h14H,2-13,16H2,1H3
InChIKeyGCVNNHGREKWOJA-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.54
Rot. Bonds6

About N'-(6-oxaspiro[4.5]decan-9-yl)-N'-propylpropane-1,3-diamine

N'-(6-oxaspiro[4.5]decan-9-yl)-N'-propylpropane-1,3-diamine (PubChem CID 79904792) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N'-(6-oxaspiro[4.5]decan-9-yl)-N'-propylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-(6-oxaspiro[4.5]decan-9-yl)-N'-propylpropane-1,3-diamine
PubChem CID79904792
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN'-(6-oxaspiro[4.5]decan-9-yl)-N'-propylpropane-1,3-diamine
SMILESCCCN(CCCN)C1CCOC2(CCCC2)C1
InChIInChI=1S/C15H30N2O/c1-2-10-17(11-5-9-16)14-6-12-18-15(13-14)7-3-4-8-15/h14H,2-13,16H2,1H3
InChIKeyGCVNNHGREKWOJA-UHFFFAOYSA-N
XLogP2.54
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)-N'-propylpropane-1,3-diamine
CID 79904584
N'-butyl-N'-(5-oxaspiro[3.5]nonan-8-yl)ethane-1,2-diamine
CID 79920705
2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]ethanol
CID 79919654
N'-ethyl-N'-(6-oxaspiro[4.5]decan-9-yl)ethane-1,2-diamine
CID 79898283
2-[5-oxaspiro[3.5]nonan-8-yl(propyl)amino]ethanol
CID 79919770
2-[6-oxaspiro[4.5]decan-9-yl(propyl)amino]acetonitrile
CID 79903017
N'-(6-oxaspiro[4.5]decan-9-yl)-N'-propan-2-ylpropane-1,3-diamine
CID 79905220
2,2-dimethyl-N'-(5-oxaspiro[3.5]nonan-8-yl)-N'-propylpropane-1,3-diamine
CID 79898830
N'-cyclopentyl-N'-(1-oxaspiro[5.5]undecan-4-yl)propane-1,3-diamine
CID 79901023
2-[5-oxaspiro[3.5]nonan-8-yl(propyl)amino]acetic acid
CID 79894587
N-propyl-N-(pyrrolidin-2-ylmethyl)-6-oxaspiro[4.5]decan-9-amine
CID 106615997
2-[2-hydroxyethyl(1-oxaspiro[5.5]undecan-4-yl)amino]ethanol
CID 79920437

Frequently Asked Questions

What is the IUPAC name of N'-(6-oxaspiro[4.5]decan-9-yl)-N'-propylpropane-1,3-diamine?
The IUPAC name of N'-(6-oxaspiro[4.5]decan-9-yl)-N'-propylpropane-1,3-diamine (CID 79904792) is N'-(6-oxaspiro[4.5]decan-9-yl)-N'-propylpropane-1,3-diamine.
What is the SMILES notation for N'-(6-oxaspiro[4.5]decan-9-yl)-N'-propylpropane-1,3-diamine?
The canonical SMILES for N'-(6-oxaspiro[4.5]decan-9-yl)-N'-propylpropane-1,3-diamine is CCCN(CCCN)C1CCOC2(CCCC2)C1.
What is the InChIKey of N'-(6-oxaspiro[4.5]decan-9-yl)-N'-propylpropane-1,3-diamine?
The InChIKey is GCVNNHGREKWOJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-2-10-17(11-5-9-16)14-6-12-18-15(13-14)7-3-4-8-15/h14H,2-13,16H2,1H3.
What are the key properties of N'-(6-oxaspiro[4.5]decan-9-yl)-N'-propylpropane-1,3-diamine?
N'-(6-oxaspiro[4.5]decan-9-yl)-N'-propylpropane-1,3-diamine has a molecular weight of 254.42 g/mol, XLogP of 2.54, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(6-oxaspiro[4.5]decan-9-yl)-N'-propylpropane-1,3-diamine is sourced from PubChem (CID 79904792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).