4-amino-N,N,3-trimethylpentanamide

C8H18N2O — CID 102537836

IUPAC4-amino-N,N,3-trimethylpentanamide
SMILESCC(N)C(C)CC(=O)N(C)C
InChIInChI=1S/C8H18N2O/c1-6(7(2)9)5-8(11)10(3)4/h6-7H,5,9H2,1-4H3
InChIKeyWHOFVPGJKMHRJV-UHFFFAOYSA-N
MW158.24 g/mol
LogP0.45
Rot. Bonds3

About 4-amino-N,N,3-trimethylpentanamide

4-amino-N,N,3-trimethylpentanamide (PubChem CID 102537836) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is 4-amino-N,N,3-trimethylpentanamide.

Molecular Properties

Compound Name4-amino-N,N,3-trimethylpentanamide
PubChem CID102537836
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name4-amino-N,N,3-trimethylpentanamide
SMILESCC(N)C(C)CC(=O)N(C)C
InChIInChI=1S/C8H18N2O/c1-6(7(2)9)5-8(11)10(3)4/h6-7H,5,9H2,1-4H3
InChIKeyWHOFVPGJKMHRJV-UHFFFAOYSA-N
XLogP0.45
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-4,4,4-trifluoro-N,N-dimethylbutanamide
CID 58772889
(3R)-N,N,3-trimethylhexanamide
CID 170848594
N,N,3-trimethylpent-4-enamide
CID 10654310
5-(dimethylamino)-N,N,3-trimethyl-5-sulfanylidenepentanamide
CID 12500633
3,4-dihydroxy-N,N-dimethylbutanamide
CID 21025486
3-amino-N,N-dimethyl-3-phenylpropanamide
CID 24691874
3-[[(2S)-1-hydroxypropan-2-yl]amino]-N,N-dimethylbutanamide
CID 103789069
(3R,5R)-3,5-dihydroxy-N',N'-dimethylheptanediamide
CID 87632154
(3R)-3-hydroxy-N,N,4,4-tetramethylpentanamide
CID 13197450
3-[[(2R)-2-hydroxypropyl]amino]-N,N-dimethylbutanamide
CID 103906702
3-amino-N,N-dimethyl-4-phenylbutanamide
CID 70115085
3-(6-hydroxyhexylamino)-N,N-dimethylbutanamide
CID 115906805

Frequently Asked Questions

What is the IUPAC name of 4-amino-N,N,3-trimethylpentanamide?
The IUPAC name of 4-amino-N,N,3-trimethylpentanamide (CID 102537836) is 4-amino-N,N,3-trimethylpentanamide.
What is the SMILES notation for 4-amino-N,N,3-trimethylpentanamide?
The canonical SMILES for 4-amino-N,N,3-trimethylpentanamide is CC(N)C(C)CC(=O)N(C)C.
What is the InChIKey of 4-amino-N,N,3-trimethylpentanamide?
The InChIKey is WHOFVPGJKMHRJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-6(7(2)9)5-8(11)10(3)4/h6-7H,5,9H2,1-4H3.
What are the key properties of 4-amino-N,N,3-trimethylpentanamide?
4-amino-N,N,3-trimethylpentanamide has a molecular weight of 158.24 g/mol, XLogP of 0.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N,N,3-trimethylpentanamide is sourced from PubChem (CID 102537836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).