5-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)hexanamide

C13H27N3O — CID 82851299

IUPAC5-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)hexanamide
SMILESCC(N)CCCC(=O)N(C)CCN1CCCC1
InChIInChI=1S/C13H27N3O/c1-12(14)6-5-7-13(17)15(2)10-11-16-8-3-4-9-16/h12H,3-11,14H2,1-2H3
InChIKeySYLJDXCLDSIDDI-UHFFFAOYSA-N
MW241.38 g/mol
LogP1.06
Rot. Bonds7

About 5-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)hexanamide

5-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)hexanamide (PubChem CID 82851299) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is 5-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)hexanamide.

Molecular Properties

Compound Name5-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)hexanamide
PubChem CID82851299
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC Name5-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)hexanamide
SMILESCC(N)CCCC(=O)N(C)CCN1CCCC1
InChIInChI=1S/C13H27N3O/c1-12(14)6-5-7-13(17)15(2)10-11-16-8-3-4-9-16/h12H,3-11,14H2,1-2H3
InChIKeySYLJDXCLDSIDDI-UHFFFAOYSA-N
XLogP1.06
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide
CID 63207232
7-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)heptanamide
CID 63207884
6-[methyl(2-pyrrolidin-1-ylethyl)amino]-6-oxohexanoic acid
CID 63207758
N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide
CID 63239691
5-amino-N-[2-(dimethylamino)ethyl]-N-methylhexanamide
CID 82852143
N-methyl-N-[6-[methyl(3-piperidin-1-ylpropanoyl)amino]hexyl]-3-piperidin-1-ylpropanamide
CID 10477358
5-amino-N-ethyl-N-methylhexanamide
CID 82848384
5-amino-N-methyl-N-(3,3,3-trifluoropropyl)hexanamide
CID 82851778
5-amino-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]hexanamide
CID 82851487
4-amino-3-methoxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide
CID 103155857
N-(3-amino-3-sulfanylidenepropyl)-N-methyl-3-[methyl(2-pyrrolidin-1-ylethyl)amino]propanamide
CID 63207759
N,3,3-trimethyl-N-(2-piperidin-1-ylethyl)butanamide
CID 110753417

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)hexanamide?
The IUPAC name of 5-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)hexanamide (CID 82851299) is 5-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)hexanamide.
What is the SMILES notation for 5-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)hexanamide?
The canonical SMILES for 5-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)hexanamide is CC(N)CCCC(=O)N(C)CCN1CCCC1.
What is the InChIKey of 5-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)hexanamide?
The InChIKey is SYLJDXCLDSIDDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-12(14)6-5-7-13(17)15(2)10-11-16-8-3-4-9-16/h12H,3-11,14H2,1-2H3.
What are the key properties of 5-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)hexanamide?
5-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)hexanamide has a molecular weight of 241.38 g/mol, XLogP of 1.06, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)hexanamide is sourced from PubChem (CID 82851299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).