3-(cyclopropylamino)-N-[(4-methylmorpholin-2-yl)methyl]propanamide

C12H23N3O2 — CID 79082583

IUPAC3-(cyclopropylamino)-N-[(4-methylmorpholin-2-yl)methyl]propanamide
SMILESCN1CCOC(CNC(=O)CCNC2CC2)C1
InChIInChI=1S/C12H23N3O2/c1-15-6-7-17-11(9-15)8-14-12(16)4-5-13-10-2-3-10/h10-11,13H,2-9H2,1H3,(H,14,16)
InChIKeyPDAMVTVRMOWSPY-UHFFFAOYSA-N
MW241.33 g/mol
LogP-0.42
Rot. Bonds6

About 3-(cyclopropylamino)-N-[(4-methylmorpholin-2-yl)methyl]propanamide

3-(cyclopropylamino)-N-[(4-methylmorpholin-2-yl)methyl]propanamide (PubChem CID 79082583) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 3-(cyclopropylamino)-N-[(4-methylmorpholin-2-yl)methyl]propanamide.

Molecular Properties

Compound Name3-(cyclopropylamino)-N-[(4-methylmorpholin-2-yl)methyl]propanamide
PubChem CID79082583
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name3-(cyclopropylamino)-N-[(4-methylmorpholin-2-yl)methyl]propanamide
SMILESCN1CCOC(CNC(=O)CCNC2CC2)C1
InChIInChI=1S/C12H23N3O2/c1-15-6-7-17-11(9-15)8-14-12(16)4-5-13-10-2-3-10/h10-11,13H,2-9H2,1H3,(H,14,16)
InChIKeyPDAMVTVRMOWSPY-UHFFFAOYSA-N
XLogP-0.42
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 5-0.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(cyclopropylamino)-N-[(1,4-dimethylpiperazin-2-yl)methyl]propanamide
CID 63896562
N-[[(2S)-4-methylmorpholin-2-yl]methyl]acetamide
CID 170608678
N-[(4-methylmorpholin-2-yl)methyl]acetamide
CID 69087754
3,3-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]butanamide
CID 49094753
4,4-dichloro-N-[(4-methylmorpholin-2-yl)methyl]but-3-enamide
CID 167947409
2-(azetidin-3-yl)-N-[(4-methylmorpholin-2-yl)methyl]acetamide
CID 79083364
2-amino-N-[2-[(4-methylmorpholin-2-yl)methylamino]-2-oxoethyl]acetamide
CID 79082878
3-[(4-methylmorpholin-2-yl)methylamino]propanamide
CID 78945349
2-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide
CID 153398973
methyl 2-[(4-methylmorpholin-2-yl)methylamino]-2-oxoacetate
CID 112617409
2-(cyclopropylamino)-N-[(4-ethylmorpholin-2-yl)methyl]acetamide
CID 115976412
N-[(4-methylmorpholin-2-yl)methyl]-2-phenylacetamide
CID 110710224

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylamino)-N-[(4-methylmorpholin-2-yl)methyl]propanamide?
The IUPAC name of 3-(cyclopropylamino)-N-[(4-methylmorpholin-2-yl)methyl]propanamide (CID 79082583) is 3-(cyclopropylamino)-N-[(4-methylmorpholin-2-yl)methyl]propanamide.
What is the SMILES notation for 3-(cyclopropylamino)-N-[(4-methylmorpholin-2-yl)methyl]propanamide?
The canonical SMILES for 3-(cyclopropylamino)-N-[(4-methylmorpholin-2-yl)methyl]propanamide is CN1CCOC(CNC(=O)CCNC2CC2)C1.
What is the InChIKey of 3-(cyclopropylamino)-N-[(4-methylmorpholin-2-yl)methyl]propanamide?
The InChIKey is PDAMVTVRMOWSPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-15-6-7-17-11(9-15)8-14-12(16)4-5-13-10-2-3-10/h10-11,13H,2-9H2,1H3,(H,14,16).
What are the key properties of 3-(cyclopropylamino)-N-[(4-methylmorpholin-2-yl)methyl]propanamide?
3-(cyclopropylamino)-N-[(4-methylmorpholin-2-yl)methyl]propanamide has a molecular weight of 241.33 g/mol, XLogP of -0.42, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylamino)-N-[(4-methylmorpholin-2-yl)methyl]propanamide is sourced from PubChem (CID 79082583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).