2-[2-(aminomethyl)morpholin-4-yl]-N-cyclopropylpropanamide

C11H21N3O2 — CID 61338383

IUPAC2-[2-(aminomethyl)morpholin-4-yl]-N-cyclopropylpropanamide
SMILESCC(C(=O)NC1CC1)N1CCOC(CN)C1
InChIInChI=1S/C11H21N3O2/c1-8(11(15)13-9-2-3-9)14-4-5-16-10(6-12)7-14/h8-10H,2-7,12H2,1H3,(H,13,15)
InChIKeyDNUZUKOXMMPMDI-UHFFFAOYSA-N
MW227.31 g/mol
LogP-0.69
Rot. Bonds4

About 2-[2-(aminomethyl)morpholin-4-yl]-N-cyclopropylpropanamide

2-[2-(aminomethyl)morpholin-4-yl]-N-cyclopropylpropanamide (PubChem CID 61338383) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is 2-[2-(aminomethyl)morpholin-4-yl]-N-cyclopropylpropanamide.

Molecular Properties

Compound Name2-[2-(aminomethyl)morpholin-4-yl]-N-cyclopropylpropanamide
PubChem CID61338383
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name2-[2-(aminomethyl)morpholin-4-yl]-N-cyclopropylpropanamide
SMILESCC(C(=O)NC1CC1)N1CCOC(CN)C1
InChIInChI=1S/C11H21N3O2/c1-8(11(15)13-9-2-3-9)14-4-5-16-10(6-12)7-14/h8-10H,2-7,12H2,1H3,(H,13,15)
InChIKeyDNUZUKOXMMPMDI-UHFFFAOYSA-N
XLogP-0.69
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-0.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(aminomethyl)morpholin-4-yl]-N-cyclopropylpropanamide?
The IUPAC name of 2-[2-(aminomethyl)morpholin-4-yl]-N-cyclopropylpropanamide (CID 61338383) is 2-[2-(aminomethyl)morpholin-4-yl]-N-cyclopropylpropanamide.
What is the SMILES notation for 2-[2-(aminomethyl)morpholin-4-yl]-N-cyclopropylpropanamide?
The canonical SMILES for 2-[2-(aminomethyl)morpholin-4-yl]-N-cyclopropylpropanamide is CC(C(=O)NC1CC1)N1CCOC(CN)C1.
What is the InChIKey of 2-[2-(aminomethyl)morpholin-4-yl]-N-cyclopropylpropanamide?
The InChIKey is DNUZUKOXMMPMDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-8(11(15)13-9-2-3-9)14-4-5-16-10(6-12)7-14/h8-10H,2-7,12H2,1H3,(H,13,15).
What are the key properties of 2-[2-(aminomethyl)morpholin-4-yl]-N-cyclopropylpropanamide?
2-[2-(aminomethyl)morpholin-4-yl]-N-cyclopropylpropanamide has a molecular weight of 227.31 g/mol, XLogP of -0.69, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(aminomethyl)morpholin-4-yl]-N-cyclopropylpropanamide is sourced from PubChem (CID 61338383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).