2-cyclopropyl-2-(cyclopropylamino)-3-(2-methylmorpholin-4-yl)propanoic acid

C14H24N2O3 — CID 63907482

IUPAC2-cyclopropyl-2-(cyclopropylamino)-3-(2-methylmorpholin-4-yl)propanoic acid
SMILESCC1CN(CC(NC2CC2)(C(=O)O)C2CC2)CCO1
InChIInChI=1S/C14H24N2O3/c1-10-8-16(6-7-19-10)9-14(13(17)18,11-2-3-11)15-12-4-5-12/h10-12,15H,2-9H2,1H3,(H,17,18)
InChIKeyACIQSTYLHQQBEI-UHFFFAOYSA-N
MW268.36 g/mol
LogP0.69
Rot. Bonds6

About 2-cyclopropyl-2-(cyclopropylamino)-3-(2-methylmorpholin-4-yl)propanoic acid

2-cyclopropyl-2-(cyclopropylamino)-3-(2-methylmorpholin-4-yl)propanoic acid (PubChem CID 63907482) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-cyclopropyl-2-(cyclopropylamino)-3-(2-methylmorpholin-4-yl)propanoic acid.

Molecular Properties

Compound Name2-cyclopropyl-2-(cyclopropylamino)-3-(2-methylmorpholin-4-yl)propanoic acid
PubChem CID63907482
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name2-cyclopropyl-2-(cyclopropylamino)-3-(2-methylmorpholin-4-yl)propanoic acid
SMILESCC1CN(CC(NC2CC2)(C(=O)O)C2CC2)CCO1
InChIInChI=1S/C14H24N2O3/c1-10-8-16(6-7-19-10)9-14(13(17)18,11-2-3-11)15-12-4-5-12/h10-12,15H,2-9H2,1H3,(H,17,18)
InChIKeyACIQSTYLHQQBEI-UHFFFAOYSA-N
XLogP0.69
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-cyclopropyl-2-(cyclopropylamino)-3-(2-methylmorpholin-4-yl)propanoate
CID 63907865
2-cyclopropyl-2-(cyclopropylamino)-3-[3-(methoxymethyl)pyrrolidin-1-yl]propanoic acid
CID 64583342
2-methyl-2-[(2-methylmorpholin-4-yl)methyl]butanoic acid
CID 62272293
ethyl 2-amino-2-cyclopropyl-3-(2-methylmorpholin-4-yl)propanoate
CID 63907673
2-cyclopropyl-2-(cyclopropylamino)-3-(4-methylpiperidin-1-yl)propanamide
CID 63907004
2-cyclopropyl-2-(cyclopropylamino)-3-(3-methoxypyrrolidin-1-yl)propanamide
CID 103537930
2,2-dimethyl-3-(2-methylmorpholin-4-yl)propan-1-ol
CID 62271256
N,2-dimethyl-1-(2-methylmorpholin-4-yl)propan-2-amine
CID 62848033
2-(ethylamino)-2-methyl-3-(2-methylmorpholin-4-yl)propan-1-ol
CID 64798661
ethyl 2-cyclopropyl-2-(cyclopropylamino)-3-(3,4-dimethylpyrrolidin-1-yl)propanoate
CID 79177875
methyl 2-[(2S)-2-methylmorpholin-4-yl]acetate
CID 28880549
2,2-dimethyl-3-(2-methylmorpholin-4-yl)propanal
CID 62276745

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(cyclopropylamino)-3-(2-methylmorpholin-4-yl)propanoic acid?
The IUPAC name of 2-cyclopropyl-2-(cyclopropylamino)-3-(2-methylmorpholin-4-yl)propanoic acid (CID 63907482) is 2-cyclopropyl-2-(cyclopropylamino)-3-(2-methylmorpholin-4-yl)propanoic acid.
What is the SMILES notation for 2-cyclopropyl-2-(cyclopropylamino)-3-(2-methylmorpholin-4-yl)propanoic acid?
The canonical SMILES for 2-cyclopropyl-2-(cyclopropylamino)-3-(2-methylmorpholin-4-yl)propanoic acid is CC1CN(CC(NC2CC2)(C(=O)O)C2CC2)CCO1.
What is the InChIKey of 2-cyclopropyl-2-(cyclopropylamino)-3-(2-methylmorpholin-4-yl)propanoic acid?
The InChIKey is ACIQSTYLHQQBEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-10-8-16(6-7-19-10)9-14(13(17)18,11-2-3-11)15-12-4-5-12/h10-12,15H,2-9H2,1H3,(H,17,18).
What are the key properties of 2-cyclopropyl-2-(cyclopropylamino)-3-(2-methylmorpholin-4-yl)propanoic acid?
2-cyclopropyl-2-(cyclopropylamino)-3-(2-methylmorpholin-4-yl)propanoic acid has a molecular weight of 268.36 g/mol, XLogP of 0.69, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(cyclopropylamino)-3-(2-methylmorpholin-4-yl)propanoic acid is sourced from PubChem (CID 63907482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).