N-(2-aminobutyl)-4-(dimethylamino)butanamide

C10H23N3O — CID 175578312

IUPACN-(2-aminobutyl)-4-(dimethylamino)butanamide
SMILESCCC(N)CNC(=O)CCCN(C)C
InChIInChI=1S/C10H23N3O/c1-4-9(11)8-12-10(14)6-5-7-13(2)3/h9H,4-8,11H2,1-3H3,(H,12,14)
InChIKeyMJBUKYQNWDJFCD-UHFFFAOYSA-N
MW201.31 g/mol
LogP0.18
Rot. Bonds7

About N-(2-aminobutyl)-4-(dimethylamino)butanamide

N-(2-aminobutyl)-4-(dimethylamino)butanamide (PubChem CID 175578312) has the molecular formula C10H23N3O and a molecular weight of 201.31 g/mol. Its IUPAC name is N-(2-aminobutyl)-4-(dimethylamino)butanamide.

Molecular Properties

Compound NameN-(2-aminobutyl)-4-(dimethylamino)butanamide
PubChem CID175578312
Molecular FormulaC10H23N3O
Molecular Weight201.31 g/mol
Exact Mass201.18
IUPAC NameN-(2-aminobutyl)-4-(dimethylamino)butanamide
SMILESCCC(N)CNC(=O)CCCN(C)C
InChIInChI=1S/C10H23N3O/c1-4-9(11)8-12-10(14)6-5-7-13(2)3/h9H,4-8,11H2,1-3H3,(H,12,14)
InChIKeyMJBUKYQNWDJFCD-UHFFFAOYSA-N
XLogP0.18
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-aminobutyl)-4-methylpentanamide
CID 63730752
N-(2-aminopentyl)pentanamide
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4-(dimethylamino)-N-octadecylbutanamide
CID 126689670
4-(dimethylamino)-N-(3-sulfanylpropyl)butanamide
CID 23187599
5-[[2-(dimethylamino)-3-ethylpentyl]amino]-5-oxopentanoic acid
CID 54867611
N'-[3-(dimethylamino)propyl]hexanediamide
CID 174324158
18-(dimethylamino)-N-propyloctadecanamide
CID 87286031
N-(2-aminobutyl)-3-(4-methylphenyl)propanamide
CID 63733649
N-(2-amino-4-methylpentyl)dodecanamide
CID 107158867
N-(2-amino-4-hydroxybutyl)dodecanamide
CID 54436170
N-[3-(dimethylamino)propyl]nonanamide
CID 3395805
N-(2-aminobutyl)-2-cyclopropylacetamide
CID 63733245

Frequently Asked Questions

What is the IUPAC name of N-(2-aminobutyl)-4-(dimethylamino)butanamide?
The IUPAC name of N-(2-aminobutyl)-4-(dimethylamino)butanamide (CID 175578312) is N-(2-aminobutyl)-4-(dimethylamino)butanamide.
What is the SMILES notation for N-(2-aminobutyl)-4-(dimethylamino)butanamide?
The canonical SMILES for N-(2-aminobutyl)-4-(dimethylamino)butanamide is CCC(N)CNC(=O)CCCN(C)C.
What is the InChIKey of N-(2-aminobutyl)-4-(dimethylamino)butanamide?
The InChIKey is MJBUKYQNWDJFCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O/c1-4-9(11)8-12-10(14)6-5-7-13(2)3/h9H,4-8,11H2,1-3H3,(H,12,14).
What are the key properties of N-(2-aminobutyl)-4-(dimethylamino)butanamide?
N-(2-aminobutyl)-4-(dimethylamino)butanamide has a molecular weight of 201.31 g/mol, XLogP of 0.18, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminobutyl)-4-(dimethylamino)butanamide is sourced from PubChem (CID 175578312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).