(2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide

C9H17N3O2 — CID 78972028

IUPAC(2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide
SMILESC[C@@H](N)C(=O)N(C)CC(=O)NC1CC1
InChIInChI=1S/C9H17N3O2/c1-6(10)9(14)12(2)5-8(13)11-7-3-4-7/h6-7H,3-5,10H2,1-2H3,(H,11,13)/t6-/m1/s1
InChIKeyDBQMYRVRZLSGJD-ZCFIWIBFSA-N
MW199.25 g/mol
LogP-0.93
Rot. Bonds4

About (2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide

(2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide (PubChem CID 78972028) has the molecular formula C9H17N3O2 and a molecular weight of 199.25 g/mol. Its IUPAC name is (2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide
PubChem CID78972028
Molecular FormulaC9H17N3O2
Molecular Weight199.25 g/mol
Exact Mass199.13
IUPAC Name(2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide
SMILESC[C@@H](N)C(=O)N(C)CC(=O)NC1CC1
InChIInChI=1S/C9H17N3O2/c1-6(10)9(14)12(2)5-8(13)11-7-3-4-7/h6-7H,3-5,10H2,1-2H3,(H,11,13)/t6-/m1/s1
InChIKeyDBQMYRVRZLSGJD-ZCFIWIBFSA-N
XLogP-0.93
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 5-0.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N,3-dimethylpentanamide
CID 61173174
2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N,3,3-trimethylbutanamide
CID 76893534
2-amino-N-methyl-N-[2-(methylamino)-2-oxoethyl]propanamide
CID 43375282
2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide
CID 106151192
2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
CID 60937489
(2S)-2-amino-N-[2-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]-2-oxoethyl]-3-methylbutanamide
CID 82962535
2-[[[2-(cyclopropylamino)-2-oxoethyl]-methylcarbamoyl]-methylamino]acetic acid
CID 55003311
N-cyclopropyl-2-[(N'-hydroxycarbamimidoyl)-methylamino]acetamide
CID 76944463
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide
CID 120775612
N-cyclopropyl-2-[[2-(1-hydroxypropan-2-ylsulfanyl)acetyl]-methylamino]acetamide
CID 112695476
N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-3-oxobutanamide
CID 43579629
2-[[(2R)-2-aminopropanoyl]-methylamino]acetic acid;hydrochloride
CID 88764935

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide?
The IUPAC name of (2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide (CID 78972028) is (2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide.
What is the SMILES notation for (2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide?
The canonical SMILES for (2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide is C[C@@H](N)C(=O)N(C)CC(=O)NC1CC1.
What is the InChIKey of (2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide?
The InChIKey is DBQMYRVRZLSGJD-ZCFIWIBFSA-N. The full InChI is InChI=1S/C9H17N3O2/c1-6(10)9(14)12(2)5-8(13)11-7-3-4-7/h6-7H,3-5,10H2,1-2H3,(H,11,13)/t6-/m1/s1.
What are the key properties of (2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide?
(2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide has a molecular weight of 199.25 g/mol, XLogP of -0.93, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide is sourced from PubChem (CID 78972028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).