N-(2-morpholin-4-ylethyl)prop-1-en-2-amine

C9H18N2O — CID 90245659

IUPACN-(2-morpholin-4-ylethyl)prop-1-en-2-amine
SMILESC=C(C)NCCN1CCOCC1
InChIInChI=1S/C9H18N2O/c1-9(2)10-3-4-11-5-7-12-8-6-11/h10H,1,3-8H2,2H3
InChIKeyWEBSFZRBKOSLFQ-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.44
Rot. Bonds4

About N-(2-morpholin-4-ylethyl)prop-1-en-2-amine

N-(2-morpholin-4-ylethyl)prop-1-en-2-amine (PubChem CID 90245659) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)prop-1-en-2-amine.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)prop-1-en-2-amine
PubChem CID90245659
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC NameN-(2-morpholin-4-ylethyl)prop-1-en-2-amine
SMILESC=C(C)NCCN1CCOCC1
InChIInChI=1S/C9H18N2O/c1-9(2)10-3-4-11-5-7-12-8-6-11/h10H,1,3-8H2,2H3
InChIKeyWEBSFZRBKOSLFQ-UHFFFAOYSA-N
XLogP0.44
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)prop-1-en-2-amine?
The IUPAC name of N-(2-morpholin-4-ylethyl)prop-1-en-2-amine (CID 90245659) is N-(2-morpholin-4-ylethyl)prop-1-en-2-amine.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)prop-1-en-2-amine?
The canonical SMILES for N-(2-morpholin-4-ylethyl)prop-1-en-2-amine is C=C(C)NCCN1CCOCC1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)prop-1-en-2-amine?
The InChIKey is WEBSFZRBKOSLFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-9(2)10-3-4-11-5-7-12-8-6-11/h10H,1,3-8H2,2H3.
What are the key properties of N-(2-morpholin-4-ylethyl)prop-1-en-2-amine?
N-(2-morpholin-4-ylethyl)prop-1-en-2-amine has a molecular weight of 170.26 g/mol, XLogP of 0.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)prop-1-en-2-amine is sourced from PubChem (CID 90245659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).