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

C14H28N2O — CID 55075065

IUPACN-methyl-N-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methyl]cyclopropanamine
SMILESCC(C)CNCC1CCC(CN(C)C2CC2)O1
InChIInChI=1S/C14H28N2O/c1-11(2)8-15-9-13-6-7-14(17-13)10-16(3)12-4-5-12/h11-15H,4-10H2,1-3H3
InChIKeyVEUPOYYPVVJXHX-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.87
Rot. Bonds7

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

N-methyl-N-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methyl]cyclopropanamine (PubChem CID 55075065) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-methyl-N-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-methyl-N-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methyl]cyclopropanamine
PubChem CID55075065
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-methyl-N-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methyl]cyclopropanamine
SMILESCC(C)CNCC1CCC(CN(C)C2CC2)O1
InChIInChI=1S/C14H28N2O/c1-11(2)8-15-9-13-6-7-14(17-13)10-16(3)12-4-5-12/h11-15H,4-10H2,1-3H3
InChIKeyVEUPOYYPVVJXHX-UHFFFAOYSA-N
XLogP1.87
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methyl]cyclopropanamine?
The IUPAC name of N-methyl-N-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methyl]cyclopropanamine (CID 55075065) is N-methyl-N-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-methyl-N-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methyl]cyclopropanamine?
The canonical SMILES for N-methyl-N-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methyl]cyclopropanamine is CC(C)CNCC1CCC(CN(C)C2CC2)O1.
What is the InChIKey of N-methyl-N-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methyl]cyclopropanamine?
The InChIKey is VEUPOYYPVVJXHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-11(2)8-15-9-13-6-7-14(17-13)10-16(3)12-4-5-12/h11-15H,4-10H2,1-3H3.
What are the key properties of N-methyl-N-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methyl]cyclopropanamine?
N-methyl-N-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methyl]cyclopropanamine has a molecular weight of 240.39 g/mol, XLogP of 1.87, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methyl]cyclopropanamine is sourced from PubChem (CID 55075065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).