N-butan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]acetamide

C15H31N3O — CID 106640806

IUPACN-butan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]acetamide
SMILESCCCN(CC(=O)NC(C)CC)CC1CCCNC1
InChIInChI=1S/C15H31N3O/c1-4-9-18(11-14-7-6-8-16-10-14)12-15(19)17-13(3)5-2/h13-14,16H,4-12H2,1-3H3,(H,17,19)
InChIKeyQZRZZGFWHZWCDT-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.61
Rot. Bonds8

About N-butan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]acetamide

N-butan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]acetamide (PubChem CID 106640806) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is N-butan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]acetamide.

Molecular Properties

Compound NameN-butan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]acetamide
PubChem CID106640806
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC NameN-butan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]acetamide
SMILESCCCN(CC(=O)NC(C)CC)CC1CCCNC1
InChIInChI=1S/C15H31N3O/c1-4-9-18(11-14-7-6-8-16-10-14)12-15(19)17-13(3)5-2/h13-14,16H,4-12H2,1-3H3,(H,17,19)
InChIKeyQZRZZGFWHZWCDT-UHFFFAOYSA-N
XLogP1.61
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N'-acetyl-2-[piperidin-3-ylmethyl(propyl)amino]acetohydrazide
CID 106640655
N-methyl-2-[piperidin-3-ylmethyl(propyl)amino]-N-propan-2-ylacetamide
CID 106640901
2-[piperidin-3-ylmethyl(propyl)amino]-1-pyrrolidin-1-ylethanone
CID 106640711
N-pentan-3-yl-2-[piperidin-3-ylmethyl(propan-2-yl)amino]acetamide
CID 106637889
N-(furan-2-ylmethyl)-2-[piperidin-3-ylmethyl(propyl)amino]acetamide
CID 106640892
N-methyl-2-[2-piperidin-3-ylethyl(propyl)amino]acetamide
CID 62356510
1-[2-[piperidin-3-ylmethyl(propyl)amino]acetyl]imidazolidin-2-one
CID 106640737
2-[methyl(piperidin-3-ylmethyl)amino]-N-pentan-2-ylpropanamide
CID 106636671
N-pentan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]propanamide
CID 106640714
3-[piperidin-3-ylmethyl(propyl)amino]propan-1-ol
CID 106640793
N-(2-methylsulfanylethyl)-N-(piperidin-3-ylmethyl)propan-1-amine
CID 106640432
N-(1-methoxypropan-2-yl)-2-[piperidin-3-yl(propyl)amino]acetamide
CID 63637167

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]acetamide?
The IUPAC name of N-butan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]acetamide (CID 106640806) is N-butan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]acetamide.
What is the SMILES notation for N-butan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]acetamide?
The canonical SMILES for N-butan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]acetamide is CCCN(CC(=O)NC(C)CC)CC1CCCNC1.
What is the InChIKey of N-butan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]acetamide?
The InChIKey is QZRZZGFWHZWCDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-4-9-18(11-14-7-6-8-16-10-14)12-15(19)17-13(3)5-2/h13-14,16H,4-12H2,1-3H3,(H,17,19).
What are the key properties of N-butan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]acetamide?
N-butan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]acetamide has a molecular weight of 269.43 g/mol, XLogP of 1.61, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]acetamide is sourced from PubChem (CID 106640806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).