N-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine

C16H32N2O — CID 83221053

IUPACN-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine
SMILESCCC1CCC(C)N1CC1(CNC(C)C)CCOC1
InChIInChI=1S/C16H32N2O/c1-5-15-7-6-14(4)18(15)11-16(8-9-19-12-16)10-17-13(2)3/h13-15,17H,5-12H2,1-4H3
InChIKeyDWZHBDHHADHIMG-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.65
Rot. Bonds6

About N-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine

N-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine (PubChem CID 83221053) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is N-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine
PubChem CID83221053
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC NameN-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine
SMILESCCC1CCC(C)N1CC1(CNC(C)C)CCOC1
InChIInChI=1S/C16H32N2O/c1-5-15-7-6-14(4)18(15)11-16(8-9-19-12-16)10-17-13(2)3/h13-15,17H,5-12H2,1-4H3
InChIKeyDWZHBDHHADHIMG-UHFFFAOYSA-N
XLogP2.65
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine with MolForge

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Related Compounds

N-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine
CID 83221374
N-[[1-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]cycloheptyl]methyl]propan-2-amine
CID 83220137
N-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxan-3-yl]methyl]propan-1-amine
CID 83221694
N-[[4-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxan-4-yl]methyl]ethanamine
CID 83221462
N-[[4-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxan-4-yl]methyl]cyclopropanamine
CID 83221379
N-[[3-[(2-methylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine
CID 55051462
N-[[3-[(3,4,5-trimethylpiperazin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine
CID 114539648
N-[[3-[(4-methylazepan-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine
CID 55249798
N-[[3-[(4-propylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine
CID 62258098
[1-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]cyclohexyl]methanol
CID 83221060
N,N,4-trimethyl-1-[[3-[(propan-2-ylamino)methyl]oxolan-3-yl]methyl]pyrrolidin-3-amine
CID 81475022
N-[[1-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]cyclohexyl]methyl]cyclopropanamine
CID 83220975

Frequently Asked Questions

What is the IUPAC name of N-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine?
The IUPAC name of N-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine (CID 83221053) is N-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine is CCC1CCC(C)N1CC1(CNC(C)C)CCOC1.
What is the InChIKey of N-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine?
The InChIKey is DWZHBDHHADHIMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-5-15-7-6-14(4)18(15)11-16(8-9-19-12-16)10-17-13(2)3/h13-15,17H,5-12H2,1-4H3.
What are the key properties of N-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine?
N-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine has a molecular weight of 268.44 g/mol, XLogP of 2.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine is sourced from PubChem (CID 83221053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).