2-methyl-N-(6-oxaspiro[4.5]decan-9-ylmethyl)propan-1-amine

C14H27NO — CID 79914861

IUPAC2-methyl-N-(6-oxaspiro[4.5]decan-9-ylmethyl)propan-1-amine
SMILESCC(C)CNCC1CCOC2(CCCC2)C1
InChIInChI=1S/C14H27NO/c1-12(2)10-15-11-13-5-8-16-14(9-13)6-3-4-7-14/h12-13,15H,3-11H2,1-2H3
InChIKeyOZKATPSXMGDUBB-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.97
Rot. Bonds4

About 2-methyl-N-(6-oxaspiro[4.5]decan-9-ylmethyl)propan-1-amine

2-methyl-N-(6-oxaspiro[4.5]decan-9-ylmethyl)propan-1-amine (PubChem CID 79914861) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 2-methyl-N-(6-oxaspiro[4.5]decan-9-ylmethyl)propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-(6-oxaspiro[4.5]decan-9-ylmethyl)propan-1-amine
PubChem CID79914861
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name2-methyl-N-(6-oxaspiro[4.5]decan-9-ylmethyl)propan-1-amine
SMILESCC(C)CNCC1CCOC2(CCCC2)C1
InChIInChI=1S/C14H27NO/c1-12(2)10-15-11-13-5-8-16-14(9-13)6-3-4-7-14/h12-13,15H,3-11H2,1-2H3
InChIKeyOZKATPSXMGDUBB-UHFFFAOYSA-N
XLogP2.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-(1-oxa-9-thiaspiro[5.5]undecan-4-ylmethyl)propan-1-amine
CID 79914967
2-methyl-N-(2-methylpropyl)-3-(6-oxaspiro[4.5]decan-9-yl)propan-1-amine
CID 79923005
N-(5-oxaspiro[3.5]nonan-8-ylmethyl)propan-2-amine
CID 79914114
N-(6-oxaspiro[4.5]decan-9-ylmethyl)ethanamine
CID 79914759
2-methyl-N-[3-(1-oxaspiro[5.5]undecan-4-yl)propyl]propan-1-amine
CID 79923870
N-(2-methylpropyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79898518
3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)butan-2-one
CID 79894570
N-ethyl-2-methyl-3-(5-oxaspiro[3.5]nonan-8-yl)propan-1-amine
CID 79923385
1-(1-oxaspiro[5.5]undecan-4-yl)propan-2-one
CID 79894719
2-methyl-3-(6-oxaspiro[4.5]decan-9-yl)propan-1-amine
CID 79924373
2-(6-oxaspiro[4.5]decan-9-yl)acetaldehyde
CID 79920475
4-(6-oxaspiro[4.5]decan-9-yl)butan-2-one
CID 79923955

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(6-oxaspiro[4.5]decan-9-ylmethyl)propan-1-amine?
The IUPAC name of 2-methyl-N-(6-oxaspiro[4.5]decan-9-ylmethyl)propan-1-amine (CID 79914861) is 2-methyl-N-(6-oxaspiro[4.5]decan-9-ylmethyl)propan-1-amine.
What is the SMILES notation for 2-methyl-N-(6-oxaspiro[4.5]decan-9-ylmethyl)propan-1-amine?
The canonical SMILES for 2-methyl-N-(6-oxaspiro[4.5]decan-9-ylmethyl)propan-1-amine is CC(C)CNCC1CCOC2(CCCC2)C1.
What is the InChIKey of 2-methyl-N-(6-oxaspiro[4.5]decan-9-ylmethyl)propan-1-amine?
The InChIKey is OZKATPSXMGDUBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-12(2)10-15-11-13-5-8-16-14(9-13)6-3-4-7-14/h12-13,15H,3-11H2,1-2H3.
What are the key properties of 2-methyl-N-(6-oxaspiro[4.5]decan-9-ylmethyl)propan-1-amine?
2-methyl-N-(6-oxaspiro[4.5]decan-9-ylmethyl)propan-1-amine has a molecular weight of 225.38 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(6-oxaspiro[4.5]decan-9-ylmethyl)propan-1-amine is sourced from PubChem (CID 79914861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).