3-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-methylbutanamide

C10H19N3O2 — CID 64684778

IUPAC3-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-methylbutanamide
SMILESCC(C)(N)CC(=O)NCC(=O)NC1CC1
InChIInChI=1S/C10H19N3O2/c1-10(2,11)5-8(14)12-6-9(15)13-7-3-4-7/h7H,3-6,11H2,1-2H3,(H,12,14)(H,13,15)
InChIKeyBIMGGGUGALPITG-UHFFFAOYSA-N
MW213.28 g/mol
LogP-0.49
Rot. Bonds5

About 3-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-methylbutanamide

3-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-methylbutanamide (PubChem CID 64684778) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is 3-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-methylbutanamide.

Molecular Properties

Compound Name3-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-methylbutanamide
PubChem CID64684778
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name3-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-methylbutanamide
SMILESCC(C)(N)CC(=O)NCC(=O)NC1CC1
InChIInChI=1S/C10H19N3O2/c1-10(2,11)5-8(14)12-6-9(15)13-7-3-4-7/h7H,3-6,11H2,1-2H3,(H,12,14)(H,13,15)
InChIKeyBIMGGGUGALPITG-UHFFFAOYSA-N
XLogP-0.49
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 5-0.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-2,2,3-trimethylbutanamide
CID 65264740
2-amino-2-cyclopropyl-N-[2-(cyclopropylamino)-2-oxoethyl]propanamide
CID 60866101
2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3,3,3-trifluoro-2-methylpropanamide
CID 79797691
3-amino-3-methyl-N-(oxan-4-yl)butanamide
CID 64684396
2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]acetamide
CID 43515302
3-[[2-(cyclopropylamino)-2-oxoethyl]carbamoylamino]-3-methylbutanoic acid
CID 64701436
2-(cyclopropylamino)-N-[2-(cyclopropylamino)-2-oxoethyl]acetamide
CID 60842326
N,N'-dicyclopropyl-3,3-dimethylpentanediamide
CID 59002749
3-amino-3-methyl-N-(4-phenylcyclohexyl)butanamide
CID 64683408
ethane;N-[4-(propanoylamino)cyclohexyl]propanamide
CID 144871719
[4-[(3-amino-3-methylbutanoyl)amino]cyclohexyl]methyl nitrate
CID 67929893
2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-2-methylpropanamide
CID 61220192

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-methylbutanamide?
The IUPAC name of 3-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-methylbutanamide (CID 64684778) is 3-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-methylbutanamide.
What is the SMILES notation for 3-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-methylbutanamide?
The canonical SMILES for 3-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-methylbutanamide is CC(C)(N)CC(=O)NCC(=O)NC1CC1.
What is the InChIKey of 3-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-methylbutanamide?
The InChIKey is BIMGGGUGALPITG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-10(2,11)5-8(14)12-6-9(15)13-7-3-4-7/h7H,3-6,11H2,1-2H3,(H,12,14)(H,13,15).
What are the key properties of 3-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-methylbutanamide?
3-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-methylbutanamide has a molecular weight of 213.28 g/mol, XLogP of -0.49, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-methylbutanamide is sourced from PubChem (CID 64684778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).