methyl 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propanoate

C16H30N2O3 — CID 63909549

IUPACmethyl 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propanoate
SMILESCCC1COCCN1CC(NC(C)C)(C(=O)OC)C1CC1
InChIInChI=1S/C16H30N2O3/c1-5-14-10-21-9-8-18(14)11-16(13-6-7-13,15(19)20-4)17-12(2)3/h12-14,17H,5-11H2,1-4H3
InChIKeyZUHZUBKFUOGXNY-UHFFFAOYSA-N
MW298.43 g/mol
LogP1.42
Rot. Bonds7

About methyl 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propanoate

methyl 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propanoate (PubChem CID 63909549) has the molecular formula C16H30N2O3 and a molecular weight of 298.43 g/mol. Its IUPAC name is methyl 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propanoate.

Molecular Properties

Compound Namemethyl 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propanoate
PubChem CID63909549
Molecular FormulaC16H30N2O3
Molecular Weight298.43 g/mol
Exact Mass298.23
IUPAC Namemethyl 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propanoate
SMILESCCC1COCCN1CC(NC(C)C)(C(=O)OC)C1CC1
InChIInChI=1S/C16H30N2O3/c1-5-14-10-21-9-8-18(14)11-16(13-6-7-13,15(19)20-4)17-12(2)3/h12-14,17H,5-11H2,1-4H3
InChIKeyZUHZUBKFUOGXNY-UHFFFAOYSA-N
XLogP1.42
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze methyl 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propan-1-ol
CID 64798573
methyl 2-cyclopropyl-3-(2-methylpiperidin-1-yl)-2-(propan-2-ylamino)propanoate
CID 63907850
methyl 2-cyclopropyl-3-(2,6-dimethylpiperidin-1-yl)-2-(propan-2-ylamino)propanoate
CID 63908288
2-amino-2-cyclopropyl-3-(3-ethylmorpholin-4-yl)propanoic acid
CID 63909942
2-cyclopropyl-3-(5-ethyl-2-methylmorpholin-4-yl)-2-(propan-2-ylamino)propanamide
CID 63909471
methyl 2-cyclopropyl-3-(3,4-dimethylpiperazin-1-yl)-2-(propan-2-ylamino)propanoate
CID 63926632
2-[(3-ethylmorpholin-4-yl)methyl]-2-methylbutanoic acid
CID 62272323
methyl 2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]-2-(propan-2-ylamino)propanoate
CID 63921517
methyl 2-cyclopropyl-3-(2-methylbutan-2-yloxy)-2-(propan-2-ylamino)propanoate
CID 63919161
methyl 3-[butan-2-yl(methyl)amino]-2-cyclopropyl-2-(propan-2-ylamino)propanoate
CID 63908711
N-(cyclopentylmethyl)-2-(3-ethylmorpholin-4-yl)ethanamine
CID 55089657
2-amino-2-cyclopropyl-3-(3-ethylmorpholin-4-yl)propanenitrile
CID 63912223

Frequently Asked Questions

What is the IUPAC name of methyl 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propanoate?
The IUPAC name of methyl 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propanoate (CID 63909549) is methyl 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propanoate.
What is the SMILES notation for methyl 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propanoate?
The canonical SMILES for methyl 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propanoate is CCC1COCCN1CC(NC(C)C)(C(=O)OC)C1CC1.
What is the InChIKey of methyl 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propanoate?
The InChIKey is ZUHZUBKFUOGXNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O3/c1-5-14-10-21-9-8-18(14)11-16(13-6-7-13,15(19)20-4)17-12(2)3/h12-14,17H,5-11H2,1-4H3.
What are the key properties of methyl 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propanoate?
methyl 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propanoate has a molecular weight of 298.43 g/mol, XLogP of 1.42, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propanoate is sourced from PubChem (CID 63909549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).