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

C17H34N2O2 — CID 62460799

IUPAC2-methyl-N-[[5-[2-(1-methylpyrrolidin-2-yl)ethoxymethyl]oxolan-2-yl]methyl]propan-1-amine
SMILESCC(C)CNCC1CCC(COCCC2CCCN2C)O1
InChIInChI=1S/C17H34N2O2/c1-14(2)11-18-12-16-6-7-17(21-16)13-20-10-8-15-5-4-9-19(15)3/h14-18H,4-13H2,1-3H3
InChIKeyWOXOVXHHXALZCQ-UHFFFAOYSA-N
MW298.47 g/mol
LogP2.28
Rot. Bonds9

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

2-methyl-N-[[5-[2-(1-methylpyrrolidin-2-yl)ethoxymethyl]oxolan-2-yl]methyl]propan-1-amine (PubChem CID 62460799) has the molecular formula C17H34N2O2 and a molecular weight of 298.47 g/mol. Its IUPAC name is 2-methyl-N-[[5-[2-(1-methylpyrrolidin-2-yl)ethoxymethyl]oxolan-2-yl]methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[[5-[2-(1-methylpyrrolidin-2-yl)ethoxymethyl]oxolan-2-yl]methyl]propan-1-amine
PubChem CID62460799
Molecular FormulaC17H34N2O2
Molecular Weight298.47 g/mol
Exact Mass298.26
IUPAC Name2-methyl-N-[[5-[2-(1-methylpyrrolidin-2-yl)ethoxymethyl]oxolan-2-yl]methyl]propan-1-amine
SMILESCC(C)CNCC1CCC(COCCC2CCCN2C)O1
InChIInChI=1S/C17H34N2O2/c1-14(2)11-18-12-16-6-7-17(21-16)13-20-10-8-15-5-4-9-19(15)3/h14-18H,4-13H2,1-3H3
InChIKeyWOXOVXHHXALZCQ-UHFFFAOYSA-N
XLogP2.28
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.47
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine
CID 66321864
N-[[5-(cyclohexylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine
CID 62486552
N-methyl-N-[2-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methoxy]ethyl]cyclopropanamine
CID 102740783
2-methyl-N-[[5-(propan-2-yloxymethyl)oxolan-2-yl]methyl]propan-1-amine
CID 62458043
2-methyl-N-[2-[1-[2-(1-methylpyrrolidin-2-yl)ethoxy]cyclobutyl]ethyl]propan-1-amine
CID 103273693
N-[[5-[2-(2-methylpropoxy)ethoxymethyl]oxolan-2-yl]methyl]propan-1-amine
CID 106450120
N-methyl-3-[2-(1-methylpyrrolidin-2-yl)ethoxy]propan-1-amine
CID 62459710
N-[(5-methyloxolan-2-yl)methyl]-1-(1-methylpiperidin-2-yl)methanamine
CID 82836268
N-ethyl-2-[2-(1-methylpiperidin-2-yl)ethoxy]ethanamine
CID 107912960
2-N-methyl-1-N-(2-methylpropyl)-2-N-[(1-methylpyrrolidin-2-yl)methyl]propane-1,2-diamine
CID 79312780
2-methyl-N-[[1-[2-(3-methylbutoxy)ethyl]pyrrolidin-2-yl]methyl]propan-1-amine
CID 62581454
N-[[5-[[2-methoxyethyl(propan-2-yl)amino]methyl]oxolan-2-yl]methyl]-2-methylpropan-1-amine
CID 82952810

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[5-[2-(1-methylpyrrolidin-2-yl)ethoxymethyl]oxolan-2-yl]methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[[5-[2-(1-methylpyrrolidin-2-yl)ethoxymethyl]oxolan-2-yl]methyl]propan-1-amine (CID 62460799) is 2-methyl-N-[[5-[2-(1-methylpyrrolidin-2-yl)ethoxymethyl]oxolan-2-yl]methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[[5-[2-(1-methylpyrrolidin-2-yl)ethoxymethyl]oxolan-2-yl]methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[[5-[2-(1-methylpyrrolidin-2-yl)ethoxymethyl]oxolan-2-yl]methyl]propan-1-amine is CC(C)CNCC1CCC(COCCC2CCCN2C)O1.
What is the InChIKey of 2-methyl-N-[[5-[2-(1-methylpyrrolidin-2-yl)ethoxymethyl]oxolan-2-yl]methyl]propan-1-amine?
The InChIKey is WOXOVXHHXALZCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O2/c1-14(2)11-18-12-16-6-7-17(21-16)13-20-10-8-15-5-4-9-19(15)3/h14-18H,4-13H2,1-3H3.
What are the key properties of 2-methyl-N-[[5-[2-(1-methylpyrrolidin-2-yl)ethoxymethyl]oxolan-2-yl]methyl]propan-1-amine?
2-methyl-N-[[5-[2-(1-methylpyrrolidin-2-yl)ethoxymethyl]oxolan-2-yl]methyl]propan-1-amine has a molecular weight of 298.47 g/mol, XLogP of 2.28, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[5-[2-(1-methylpyrrolidin-2-yl)ethoxymethyl]oxolan-2-yl]methyl]propan-1-amine is sourced from PubChem (CID 62460799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).