N-propan-2-yl-7-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]-7-azaspiro[3.5]nonan-2-amine

C19H36N2O — CID 169289796

IUPACN-propan-2-yl-7-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]-7-azaspiro[3.5]nonan-2-amine
SMILESCC(C)NC1CC2(CCN(CC3(COC(C)C)CC3)CC2)C1
InChIInChI=1S/C19H36N2O/c1-15(2)20-17-11-18(12-17)7-9-21(10-8-18)13-19(5-6-19)14-22-16(3)4/h15-17,20H,5-14H2,1-4H3
InChIKeyRVSPPFKRQMAYIQ-UHFFFAOYSA-N
MW308.51 g/mol
LogP3.43
Rot. Bonds7

About N-propan-2-yl-7-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]-7-azaspiro[3.5]nonan-2-amine

N-propan-2-yl-7-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]-7-azaspiro[3.5]nonan-2-amine (PubChem CID 169289796) has the molecular formula C19H36N2O and a molecular weight of 308.51 g/mol. Its IUPAC name is N-propan-2-yl-7-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]-7-azaspiro[3.5]nonan-2-amine.

Molecular Properties

Compound NameN-propan-2-yl-7-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]-7-azaspiro[3.5]nonan-2-amine
PubChem CID169289796
Molecular FormulaC19H36N2O
Molecular Weight308.51 g/mol
Exact Mass308.28
IUPAC NameN-propan-2-yl-7-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]-7-azaspiro[3.5]nonan-2-amine
SMILESCC(C)NC1CC2(CCN(CC3(COC(C)C)CC3)CC2)C1
InChIInChI=1S/C19H36N2O/c1-15(2)20-17-11-18(12-17)7-9-21(10-8-18)13-19(5-6-19)14-22-16(3)4/h15-17,20H,5-14H2,1-4H3
InChIKeyRVSPPFKRQMAYIQ-UHFFFAOYSA-N
XLogP3.43
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.51
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-7-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]-7-azaspiro[3.5]nonan-2-amine?
The IUPAC name of N-propan-2-yl-7-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]-7-azaspiro[3.5]nonan-2-amine (CID 169289796) is N-propan-2-yl-7-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]-7-azaspiro[3.5]nonan-2-amine.
What is the SMILES notation for N-propan-2-yl-7-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]-7-azaspiro[3.5]nonan-2-amine?
The canonical SMILES for N-propan-2-yl-7-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]-7-azaspiro[3.5]nonan-2-amine is CC(C)NC1CC2(CCN(CC3(COC(C)C)CC3)CC2)C1.
What is the InChIKey of N-propan-2-yl-7-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]-7-azaspiro[3.5]nonan-2-amine?
The InChIKey is RVSPPFKRQMAYIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H36N2O/c1-15(2)20-17-11-18(12-17)7-9-21(10-8-18)13-19(5-6-19)14-22-16(3)4/h15-17,20H,5-14H2,1-4H3.
What are the key properties of N-propan-2-yl-7-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]-7-azaspiro[3.5]nonan-2-amine?
N-propan-2-yl-7-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]-7-azaspiro[3.5]nonan-2-amine has a molecular weight of 308.51 g/mol, XLogP of 3.43, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-7-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]-7-azaspiro[3.5]nonan-2-amine is sourced from PubChem (CID 169289796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).