2-[(3-amino-3-oxopropyl)amino]-N-(2-methylpropyl)propanamide

C10H21N3O2 — CID 43553515

IUPAC2-[(3-amino-3-oxopropyl)amino]-N-(2-methylpropyl)propanamide
SMILESCC(C)CNC(=O)C(C)NCCC(N)=O
InChIInChI=1S/C10H21N3O2/c1-7(2)6-13-10(15)8(3)12-5-4-9(11)14/h7-8,12H,4-6H2,1-3H3,(H2,11,14)(H,13,15)
InChIKeyZNQFRIRYTOPHET-UHFFFAOYSA-N
MW215.30 g/mol
LogP-0.39
Rot. Bonds7

About 2-[(3-amino-3-oxopropyl)amino]-N-(2-methylpropyl)propanamide

2-[(3-amino-3-oxopropyl)amino]-N-(2-methylpropyl)propanamide (PubChem CID 43553515) has the molecular formula C10H21N3O2 and a molecular weight of 215.30 g/mol. Its IUPAC name is 2-[(3-amino-3-oxopropyl)amino]-N-(2-methylpropyl)propanamide.

Molecular Properties

Compound Name2-[(3-amino-3-oxopropyl)amino]-N-(2-methylpropyl)propanamide
PubChem CID43553515
Molecular FormulaC10H21N3O2
Molecular Weight215.30 g/mol
Exact Mass215.16
IUPAC Name2-[(3-amino-3-oxopropyl)amino]-N-(2-methylpropyl)propanamide
SMILESCC(C)CNC(=O)C(C)NCCC(N)=O
InChIInChI=1S/C10H21N3O2/c1-7(2)6-13-10(15)8(3)12-5-4-9(11)14/h7-8,12H,4-6H2,1-3H3,(H2,11,14)(H,13,15)
InChIKeyZNQFRIRYTOPHET-UHFFFAOYSA-N
XLogP-0.39
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 5-0.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-amino-2-oxoethyl)amino]-N-(2-methylpropyl)propanamide
CID 43089259
2-(3-methylbutylamino)-N-(2-methylpropyl)propanamide
CID 43086968
2-[(3-amino-3-oxopropyl)amino]-N-pentylpropanamide
CID 43553504
2-(4-methylpentylamino)-N-(2-methylpropyl)propanamide
CID 60745845
2-(7-methyloctylamino)-N-(2-methylpropyl)propanamide
CID 103604994
3-(propan-2-ylamino)propanamide
CID 18768059
3-[(1-amino-1-hydroxyiminopropan-2-yl)amino]propanamide
CID 77029016
2-[3-(2-methylpropoxy)propylamino]-N-(2-methylpropyl)propanamide
CID 103604221
2-[(6-amino-6-hydroxyimino-5,5-dimethylhexyl)amino]-N-(2-methylpropyl)propanamide
CID 106711557
(2S)-2-amino-N-[(2S)-1-[[(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide;hydrobromide
CID 18600444
4-[[1-oxo-1-(propan-2-ylamino)propan-2-yl]amino]butanamide
CID 60865224
N-(2-methylpropyl)-2-[(1-propan-2-ylcyclopropyl)methylamino]propanamide
CID 103742193

Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-3-oxopropyl)amino]-N-(2-methylpropyl)propanamide?
The IUPAC name of 2-[(3-amino-3-oxopropyl)amino]-N-(2-methylpropyl)propanamide (CID 43553515) is 2-[(3-amino-3-oxopropyl)amino]-N-(2-methylpropyl)propanamide.
What is the SMILES notation for 2-[(3-amino-3-oxopropyl)amino]-N-(2-methylpropyl)propanamide?
The canonical SMILES for 2-[(3-amino-3-oxopropyl)amino]-N-(2-methylpropyl)propanamide is CC(C)CNC(=O)C(C)NCCC(N)=O.
What is the InChIKey of 2-[(3-amino-3-oxopropyl)amino]-N-(2-methylpropyl)propanamide?
The InChIKey is ZNQFRIRYTOPHET-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O2/c1-7(2)6-13-10(15)8(3)12-5-4-9(11)14/h7-8,12H,4-6H2,1-3H3,(H2,11,14)(H,13,15).
What are the key properties of 2-[(3-amino-3-oxopropyl)amino]-N-(2-methylpropyl)propanamide?
2-[(3-amino-3-oxopropyl)amino]-N-(2-methylpropyl)propanamide has a molecular weight of 215.30 g/mol, XLogP of -0.39, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-3-oxopropyl)amino]-N-(2-methylpropyl)propanamide is sourced from PubChem (CID 43553515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).