N-butan-2-yl-3-(1-cyclobutylpropan-2-ylamino)propanamide

C14H28N2O — CID 115713176

IUPACN-butan-2-yl-3-(1-cyclobutylpropan-2-ylamino)propanamide
SMILESCCC(C)NC(=O)CCNC(C)CC1CCC1
InChIInChI=1S/C14H28N2O/c1-4-11(2)16-14(17)8-9-15-12(3)10-13-6-5-7-13/h11-13,15H,4-10H2,1-3H3,(H,16,17)
InChIKeyVFUCFEMRKGCGAD-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.46
Rot. Bonds8

About N-butan-2-yl-3-(1-cyclobutylpropan-2-ylamino)propanamide

N-butan-2-yl-3-(1-cyclobutylpropan-2-ylamino)propanamide (PubChem CID 115713176) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-butan-2-yl-3-(1-cyclobutylpropan-2-ylamino)propanamide.

Molecular Properties

Compound NameN-butan-2-yl-3-(1-cyclobutylpropan-2-ylamino)propanamide
PubChem CID115713176
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-butan-2-yl-3-(1-cyclobutylpropan-2-ylamino)propanamide
SMILESCCC(C)NC(=O)CCNC(C)CC1CCC1
InChIInChI=1S/C14H28N2O/c1-4-11(2)16-14(17)8-9-15-12(3)10-13-6-5-7-13/h11-13,15H,4-10H2,1-3H3,(H,16,17)
InChIKeyVFUCFEMRKGCGAD-UHFFFAOYSA-N
XLogP2.46
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-butan-2-yl-3-[1-(1-methylcyclopropyl)ethylamino]propanamide
CID 61022080
N-butan-2-yl-3-(cyclohexylamino)propanamide
CID 60956493
2-[[3-(butan-2-ylamino)-3-oxopropyl]amino]butanoic acid
CID 64667377
2-(1-cyclobutylpropan-2-ylamino)-N-ethylacetamide
CID 115707078
2-[[3-(butan-2-ylamino)-3-oxopropyl]amino]-N-propylpropanamide
CID 54901154
2-[[3-(butan-2-ylamino)-3-oxopropyl]carbamoyl]cyclopentane-1-carboxylic acid
CID 103978487
N-[(2R)-butan-2-yl]-3-[[(2R)-3,3-dimethylbutan-2-yl]amino]propanamide
CID 97230749
N-[(2S)-butan-2-yl]-3-[[(2S)-3,3-dimethylbutan-2-yl]amino]propanamide
CID 97230748
3-(1-cyclopropylpropan-2-ylamino)-N,N-diethylpropanamide
CID 115710436
N-butan-2-yl-4-(cyclohexylcarbamoylamino)butanamide
CID 134056980
2-[[3-(butan-2-ylamino)-3-oxopropyl]amino]butanamide
CID 62899086
N-[2-(butan-2-ylamino)-2-oxoethyl]cyclobutanecarboxamide
CID 112990807

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-3-(1-cyclobutylpropan-2-ylamino)propanamide?
The IUPAC name of N-butan-2-yl-3-(1-cyclobutylpropan-2-ylamino)propanamide (CID 115713176) is N-butan-2-yl-3-(1-cyclobutylpropan-2-ylamino)propanamide.
What is the SMILES notation for N-butan-2-yl-3-(1-cyclobutylpropan-2-ylamino)propanamide?
The canonical SMILES for N-butan-2-yl-3-(1-cyclobutylpropan-2-ylamino)propanamide is CCC(C)NC(=O)CCNC(C)CC1CCC1.
What is the InChIKey of N-butan-2-yl-3-(1-cyclobutylpropan-2-ylamino)propanamide?
The InChIKey is VFUCFEMRKGCGAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-4-11(2)16-14(17)8-9-15-12(3)10-13-6-5-7-13/h11-13,15H,4-10H2,1-3H3,(H,16,17).
What are the key properties of N-butan-2-yl-3-(1-cyclobutylpropan-2-ylamino)propanamide?
N-butan-2-yl-3-(1-cyclobutylpropan-2-ylamino)propanamide has a molecular weight of 240.39 g/mol, XLogP of 2.46, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-3-(1-cyclobutylpropan-2-ylamino)propanamide is sourced from PubChem (CID 115713176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).