N-cyclopropyl-2-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide

C12H21N3O2 — CID 79394773

IUPACN-cyclopropyl-2-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide
SMILESCC(NCCC(=O)NC1CC1)C(=O)NC1CC1
InChIInChI=1S/C12H21N3O2/c1-8(12(17)15-10-4-5-10)13-7-6-11(16)14-9-2-3-9/h8-10,13H,2-7H2,1H3,(H,14,16)(H,15,17)
InChIKeyBJEBZZSXBPUNAZ-UHFFFAOYSA-N
MW239.32 g/mol
LogP-0.09
Rot. Bonds7

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

N-cyclopropyl-2-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide (PubChem CID 79394773) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is N-cyclopropyl-2-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide
PubChem CID79394773
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC NameN-cyclopropyl-2-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide
SMILESCC(NCCC(=O)NC1CC1)C(=O)NC1CC1
InChIInChI=1S/C12H21N3O2/c1-8(12(17)15-10-4-5-10)13-7-6-11(16)14-9-2-3-9/h8-10,13H,2-7H2,1H3,(H,14,16)(H,15,17)
InChIKeyBJEBZZSXBPUNAZ-UHFFFAOYSA-N
XLogP-0.09
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 5-0.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(cyclopropylamino)-3-oxopropyl]-2-(methylamino)propanamide
CID 79400764
N-cyclopropyl-4-[[1-oxo-1-(pentan-3-ylamino)propan-2-yl]amino]butanamide
CID 79393960
N-cyclopropyl-2-(3-fluoropropylamino)propanamide
CID 115731798
2-[[2-(cyclopentylamino)-2-oxoethyl]amino]-N-cyclopropylpropanamide
CID 113248238
N-cyclopropyl-4-(1-cyclopropylethylamino)butanamide
CID 79394178
N-cyclopropyl-2-(6-hydroxyhexylamino)propanamide
CID 107703590
N-cyclopropyl-4-[3-(propan-2-ylamino)propanoylamino]butanamide
CID 79401446
2-(azetidin-3-yl)-N-[3-(cyclopropylamino)-3-oxopropyl]propanamide
CID 116678382
N-cyclopropyl-3-[(2,2-difluoroacetyl)amino]propanamide
CID 103515809
N-cyclopropyl-3-(2-methylpropylamino)propanamide
CID 62626467
N-cyclopropyl-3-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide
CID 79394765
N-cyclopropyl-2-[(1-methylcyclopropyl)methylamino]propanamide
CID 103724718

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide?
The IUPAC name of N-cyclopropyl-2-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide (CID 79394773) is N-cyclopropyl-2-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide.
What is the SMILES notation for N-cyclopropyl-2-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide?
The canonical SMILES for N-cyclopropyl-2-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide is CC(NCCC(=O)NC1CC1)C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide?
The InChIKey is BJEBZZSXBPUNAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-8(12(17)15-10-4-5-10)13-7-6-11(16)14-9-2-3-9/h8-10,13H,2-7H2,1H3,(H,14,16)(H,15,17).
What are the key properties of N-cyclopropyl-2-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide?
N-cyclopropyl-2-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide has a molecular weight of 239.32 g/mol, XLogP of -0.09, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide is sourced from PubChem (CID 79394773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).