3-[butan-2-yl(butyl)amino]propanamide

C11H24N2O — CID 60648074

IUPAC3-[butan-2-yl(butyl)amino]propanamide
SMILESCCCCN(CCC(N)=O)C(C)CC
InChIInChI=1S/C11H24N2O/c1-4-6-8-13(10(3)5-2)9-7-11(12)14/h10H,4-9H2,1-3H3,(H2,12,14)
InChIKeyQWLFKLPIJJKBFE-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.76
Rot. Bonds8

About 3-[butan-2-yl(butyl)amino]propanamide

3-[butan-2-yl(butyl)amino]propanamide (PubChem CID 60648074) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 3-[butan-2-yl(butyl)amino]propanamide.

Molecular Properties

Compound Name3-[butan-2-yl(butyl)amino]propanamide
PubChem CID60648074
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name3-[butan-2-yl(butyl)amino]propanamide
SMILESCCCCN(CCC(N)=O)C(C)CC
InChIInChI=1S/C11H24N2O/c1-4-6-8-13(10(3)5-2)9-7-11(12)14/h10H,4-9H2,1-3H3,(H2,12,14)
InChIKeyQWLFKLPIJJKBFE-UHFFFAOYSA-N
XLogP1.76
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[butan-2-yl(butyl)amino]propanehydrazide
CID 63577909
2-[(3-amino-3-oxopropyl)-butan-2-ylamino]acetic acid
CID 60833263
4-[butan-2-yl(butyl)amino]-2-(methylamino)butanamide
CID 63053272
1-[butan-2-yl(butyl)amino]-4-methoxy-4-methylpentan-3-one
CID 114228990
4-(dibutylamino)butanamide
CID 57071614
4-[butan-2-yl(butyl)amino]-2,2-dimethylbutanethioamide
CID 65249143
1-amino-4-[butan-2-yl(butyl)amino]butan-2-ol
CID 64818690
methyl 4-[butan-2-yl(butyl)amino]-2-(ethylamino)butanoate
CID 63054156
(2S)-5-amino-2-[butyl(dodecyl)amino]-5-oxopentanoic acid
CID 150171158
2-amino-3-[butan-2-yl(butyl)amino]-2-cyclopropylpropanamide
CID 63919688
octadecanamide;bis(propan-2-ol)
CID 90014672
4-[butan-2-yl(butyl)amino]-2-(ethylamino)butanoic acid
CID 63053630

Frequently Asked Questions

What is the IUPAC name of 3-[butan-2-yl(butyl)amino]propanamide?
The IUPAC name of 3-[butan-2-yl(butyl)amino]propanamide (CID 60648074) is 3-[butan-2-yl(butyl)amino]propanamide.
What is the SMILES notation for 3-[butan-2-yl(butyl)amino]propanamide?
The canonical SMILES for 3-[butan-2-yl(butyl)amino]propanamide is CCCCN(CCC(N)=O)C(C)CC.
What is the InChIKey of 3-[butan-2-yl(butyl)amino]propanamide?
The InChIKey is QWLFKLPIJJKBFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-4-6-8-13(10(3)5-2)9-7-11(12)14/h10H,4-9H2,1-3H3,(H2,12,14).
What are the key properties of 3-[butan-2-yl(butyl)amino]propanamide?
3-[butan-2-yl(butyl)amino]propanamide has a molecular weight of 200.33 g/mol, XLogP of 1.76, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[butan-2-yl(butyl)amino]propanamide is sourced from PubChem (CID 60648074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).