N-(2-aminoethyl)-N'-cyclopropyloxamide

C7H13N3O2 — CID 43315719

IUPACN-(2-aminoethyl)-N'-cyclopropyloxamide
SMILESNCCNC(=O)C(=O)NC1CC1
InChIInChI=1S/C7H13N3O2/c8-3-4-9-6(11)7(12)10-5-1-2-5/h5H,1-4,8H2,(H,9,11)(H,10,12)
InChIKeyZUVUQAYYBSGUHE-UHFFFAOYSA-N
MW171.20 g/mol
LogP-1.66
Rot. Bonds3

About N-(2-aminoethyl)-N'-cyclopropyloxamide

N-(2-aminoethyl)-N'-cyclopropyloxamide (PubChem CID 43315719) has the molecular formula C7H13N3O2 and a molecular weight of 171.20 g/mol. Its IUPAC name is N-(2-aminoethyl)-N'-cyclopropyloxamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N'-cyclopropyloxamide
PubChem CID43315719
Molecular FormulaC7H13N3O2
Molecular Weight171.20 g/mol
Exact Mass171.10
IUPAC NameN-(2-aminoethyl)-N'-cyclopropyloxamide
SMILESNCCNC(=O)C(=O)NC1CC1
InChIInChI=1S/C7H13N3O2/c8-3-4-9-6(11)7(12)10-5-1-2-5/h5H,1-4,8H2,(H,9,11)(H,10,12)
InChIKeyZUVUQAYYBSGUHE-UHFFFAOYSA-N
XLogP-1.66
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.20
LogP ≤ 5-1.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N-(2-aminoethyl)-N'-(4-hydroxycyclohexyl)oxamide
CID 43315763
N'-cyclopropyl-N-[2-(dimethylamino)ethyl]oxamide
CID 3312354
N-(2-aminoethyl)-N'-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)oxamide
CID 65471203
N'-cyclododecyl-N-(2-hydroxyethyl)oxamide
CID 108517410
3-[[2-(cyclopropylamino)-2-oxoacetyl]amino]propyl-dimethylazanium
CID 7321968
N'-cyclopropyl-N-[(3S)-3-hydroxy-4,4-dimethylpentyl]oxamide
CID 95984687
5-amino-N-cyclopropyl-2-oxopentanamide
CID 90386555
N'-cyclopropyl-N-[2-(4-hydroxyphenyl)ethyl]oxamide
CID 108503179
N-(2-aminoethyl)-N'-(1-cyclopropylethyl)oxamide
CID 43533108
N'-cyclopropyl-N-[(2R)-2-hydroxypropyl]oxamide
CID 51471601
N'-cyclododecyl-N-(5-hydroxypentyl)oxamide
CID 108517393
N-(2-aminoethyl)-N'-(2-amino-2-oxoethyl)oxamide
CID 43315738

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N'-cyclopropyloxamide?
The IUPAC name of N-(2-aminoethyl)-N'-cyclopropyloxamide (CID 43315719) is N-(2-aminoethyl)-N'-cyclopropyloxamide.
What is the SMILES notation for N-(2-aminoethyl)-N'-cyclopropyloxamide?
The canonical SMILES for N-(2-aminoethyl)-N'-cyclopropyloxamide is NCCNC(=O)C(=O)NC1CC1.
What is the InChIKey of N-(2-aminoethyl)-N'-cyclopropyloxamide?
The InChIKey is ZUVUQAYYBSGUHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O2/c8-3-4-9-6(11)7(12)10-5-1-2-5/h5H,1-4,8H2,(H,9,11)(H,10,12).
What are the key properties of N-(2-aminoethyl)-N'-cyclopropyloxamide?
N-(2-aminoethyl)-N'-cyclopropyloxamide has a molecular weight of 171.20 g/mol, XLogP of -1.66, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N'-cyclopropyloxamide is sourced from PubChem (CID 43315719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).