N-methyl-N-[2-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methoxy]ethyl]cyclopropanamine

C16H32N2O2 — CID 102740783

IUPACN-methyl-N-[2-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methoxy]ethyl]cyclopropanamine
SMILESCC(C)CNCC1CCC(COCCN(C)C2CC2)O1
InChIInChI=1S/C16H32N2O2/c1-13(2)10-17-11-15-6-7-16(20-15)12-19-9-8-18(3)14-4-5-14/h13-17H,4-12H2,1-3H3
InChIKeyGEBGPWFUPTYSTH-UHFFFAOYSA-N
MW284.44 g/mol
LogP1.89
Rot. Bonds10

About N-methyl-N-[2-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methoxy]ethyl]cyclopropanamine

N-methyl-N-[2-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methoxy]ethyl]cyclopropanamine (PubChem CID 102740783) has the molecular formula C16H32N2O2 and a molecular weight of 284.44 g/mol. Its IUPAC name is N-methyl-N-[2-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methoxy]ethyl]cyclopropanamine.

Molecular Properties

Compound NameN-methyl-N-[2-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methoxy]ethyl]cyclopropanamine
PubChem CID102740783
Molecular FormulaC16H32N2O2
Molecular Weight284.44 g/mol
Exact Mass284.25
IUPAC NameN-methyl-N-[2-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methoxy]ethyl]cyclopropanamine
SMILESCC(C)CNCC1CCC(COCCN(C)C2CC2)O1
InChIInChI=1S/C16H32N2O2/c1-13(2)10-17-11-15-6-7-16(20-15)12-19-9-8-18(3)14-4-5-14/h13-17H,4-12H2,1-3H3
InChIKeyGEBGPWFUPTYSTH-UHFFFAOYSA-N
XLogP1.89
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.44
LogP ≤ 51.89
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-methyl-N-[2-[[5-(propylaminomethyl)oxolan-2-yl]methoxy]ethyl]cyclopropanamine
CID 102741032
N-[[5-[2-[cyclopropyl(methyl)amino]ethoxymethyl]oxolan-2-yl]methyl]cyclopropanamine
CID 102740842
N-methyl-N-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methyl]cyclopropanamine
CID 55075065
N-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine
CID 66321864
N-[[5-[[2-ethoxyethyl(methyl)amino]methyl]oxolan-2-yl]methyl]-2-methylpropan-1-amine
CID 81068645
N-[[5-(cyclohexylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine
CID 62486552
N-methyl-N-[2-[6-(2-methylpropylamino)hexoxy]ethyl]cyclopropanamine
CID 102740718
2-methyl-N-[[5-(propan-2-yloxymethyl)oxolan-2-yl]methyl]propan-1-amine
CID 62458043
2-methyl-N-[[5-[2-(1-methylpyrrolidin-2-yl)ethoxymethyl]oxolan-2-yl]methyl]propan-1-amine
CID 62460799
N,4-dimethyl-N-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methyl]pentan-2-amine
CID 62461429
N-[[5-[[2-methoxyethyl(propan-2-yl)amino]methyl]oxolan-2-yl]methyl]-2-methylpropan-1-amine
CID 82952810
N-[[5-[2-(2-methylpropoxy)ethoxymethyl]oxolan-2-yl]methyl]propan-1-amine
CID 106450120

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methoxy]ethyl]cyclopropanamine?
The IUPAC name of N-methyl-N-[2-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methoxy]ethyl]cyclopropanamine (CID 102740783) is N-methyl-N-[2-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methoxy]ethyl]cyclopropanamine.
What is the SMILES notation for N-methyl-N-[2-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methoxy]ethyl]cyclopropanamine?
The canonical SMILES for N-methyl-N-[2-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methoxy]ethyl]cyclopropanamine is CC(C)CNCC1CCC(COCCN(C)C2CC2)O1.
What is the InChIKey of N-methyl-N-[2-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methoxy]ethyl]cyclopropanamine?
The InChIKey is GEBGPWFUPTYSTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O2/c1-13(2)10-17-11-15-6-7-16(20-15)12-19-9-8-18(3)14-4-5-14/h13-17H,4-12H2,1-3H3.
What are the key properties of N-methyl-N-[2-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methoxy]ethyl]cyclopropanamine?
N-methyl-N-[2-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methoxy]ethyl]cyclopropanamine has a molecular weight of 284.44 g/mol, XLogP of 1.89, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methoxy]ethyl]cyclopropanamine is sourced from PubChem (CID 102740783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).