N-(dicyclopropylmethyl)-3-morpholin-4-ylpropan-1-amine

C14H26N2O — CID 43362847

IUPACN-(dicyclopropylmethyl)-3-morpholin-4-ylpropan-1-amine
SMILESC(CNC(C1CC1)C1CC1)CN1CCOCC1
InChIInChI=1S/C14H26N2O/c1(7-16-8-10-17-11-9-16)6-15-14(12-2-3-12)13-4-5-13/h12-15H,1-11H2
InChIKeyBMRTYOVKXZWMLP-UHFFFAOYSA-N
MW238.37 g/mol
LogP1.49
Rot. Bonds7

About N-(dicyclopropylmethyl)-3-morpholin-4-ylpropan-1-amine

N-(dicyclopropylmethyl)-3-morpholin-4-ylpropan-1-amine (PubChem CID 43362847) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-3-morpholin-4-ylpropan-1-amine.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-3-morpholin-4-ylpropan-1-amine
PubChem CID43362847
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC NameN-(dicyclopropylmethyl)-3-morpholin-4-ylpropan-1-amine
SMILESC(CNC(C1CC1)C1CC1)CN1CCOCC1
InChIInChI=1S/C14H26N2O/c1(7-16-8-10-17-11-9-16)6-15-14(12-2-3-12)13-4-5-13/h12-15H,1-11H2
InChIKeyBMRTYOVKXZWMLP-UHFFFAOYSA-N
XLogP1.49
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 ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-3-morpholin-4-ylpropan-1-amine?
The IUPAC name of N-(dicyclopropylmethyl)-3-morpholin-4-ylpropan-1-amine (CID 43362847) is N-(dicyclopropylmethyl)-3-morpholin-4-ylpropan-1-amine.
What is the SMILES notation for N-(dicyclopropylmethyl)-3-morpholin-4-ylpropan-1-amine?
The canonical SMILES for N-(dicyclopropylmethyl)-3-morpholin-4-ylpropan-1-amine is C(CNC(C1CC1)C1CC1)CN1CCOCC1.
What is the InChIKey of N-(dicyclopropylmethyl)-3-morpholin-4-ylpropan-1-amine?
The InChIKey is BMRTYOVKXZWMLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1(7-16-8-10-17-11-9-16)6-15-14(12-2-3-12)13-4-5-13/h12-15H,1-11H2.
What are the key properties of N-(dicyclopropylmethyl)-3-morpholin-4-ylpropan-1-amine?
N-(dicyclopropylmethyl)-3-morpholin-4-ylpropan-1-amine has a molecular weight of 238.37 g/mol, XLogP of 1.49, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-3-morpholin-4-ylpropan-1-amine is sourced from PubChem (CID 43362847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).