N-[[5-[[methyl(2-methylprop-2-enyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine

C14H26N2O — CID 113498809

IUPACN-[[5-[[methyl(2-methylprop-2-enyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine
SMILESC=C(C)CN(C)CC1CCC(CNC2CC2)O1
InChIInChI=1S/C14H26N2O/c1-11(2)9-16(3)10-14-7-6-13(17-14)8-15-12-4-5-12/h12-15H,1,4-10H2,2-3H3
InChIKeyBIHQDTFGVHMVSX-UHFFFAOYSA-N
MW238.37 g/mol
LogP1.79
Rot. Bonds7

About N-[[5-[[methyl(2-methylprop-2-enyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine

N-[[5-[[methyl(2-methylprop-2-enyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine (PubChem CID 113498809) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is N-[[5-[[methyl(2-methylprop-2-enyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[5-[[methyl(2-methylprop-2-enyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine
PubChem CID113498809
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC NameN-[[5-[[methyl(2-methylprop-2-enyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine
SMILESC=C(C)CN(C)CC1CCC(CNC2CC2)O1
InChIInChI=1S/C14H26N2O/c1-11(2)9-16(3)10-14-7-6-13(17-14)8-15-12-4-5-12/h12-15H,1,4-10H2,2-3H3
InChIKeyBIHQDTFGVHMVSX-UHFFFAOYSA-N
XLogP1.79
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[[5-[[methyl(2-methylprop-2-enyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine with MolForge

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Related Compounds

N,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]prop-2-en-1-amine
CID 113498784
N-[[5-[[cyclopropylmethyl(methyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine
CID 62427288
N-[[5-[[methyl(3-methylbutan-2-yl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine
CID 62432122
N-[[5-[[furan-2-ylmethyl(methyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine
CID 62421548
N-ethyl-2-methyl-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]prop-2-en-1-amine
CID 62418405
N-[[5-[[methyl(2-pyridin-4-ylethyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine
CID 62426370
N-[[5-[[ethyl(2-methylpropyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine
CID 55074640
N-[[5-[[methyl(2-pyridin-2-ylethyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine
CID 62419597
N-[2-[4-[[methyl(2-methylprop-2-enyl)amino]methyl]phenyl]ethyl]cyclopropanamine
CID 105348285
5-[[(4-methylcyclohexyl)amino]methyl]oxolane-2-carboxylic acid
CID 103234012
N-[[5-[(cyclopropylamino)methyl]oxolan-2-yl]methyl]-2-fluoro-N-methylaniline
CID 62434907
N-[[5-[[ethyl(oxolan-2-ylmethyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine
CID 62429287

Frequently Asked Questions

What is the IUPAC name of N-[[5-[[methyl(2-methylprop-2-enyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[5-[[methyl(2-methylprop-2-enyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine (CID 113498809) is N-[[5-[[methyl(2-methylprop-2-enyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[5-[[methyl(2-methylprop-2-enyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[5-[[methyl(2-methylprop-2-enyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine is C=C(C)CN(C)CC1CCC(CNC2CC2)O1.
What is the InChIKey of N-[[5-[[methyl(2-methylprop-2-enyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine?
The InChIKey is BIHQDTFGVHMVSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-11(2)9-16(3)10-14-7-6-13(17-14)8-15-12-4-5-12/h12-15H,1,4-10H2,2-3H3.
What are the key properties of N-[[5-[[methyl(2-methylprop-2-enyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine?
N-[[5-[[methyl(2-methylprop-2-enyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine has a molecular weight of 238.37 g/mol, XLogP of 1.79, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[[methyl(2-methylprop-2-enyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine is sourced from PubChem (CID 113498809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).