2-[methyl(piperidin-3-ylmethyl)amino]-N-pentan-2-ylpropanamide

C15H31N3O — CID 106636671

IUPAC2-[methyl(piperidin-3-ylmethyl)amino]-N-pentan-2-ylpropanamide
SMILESCCCC(C)NC(=O)C(C)N(C)CC1CCCNC1
InChIInChI=1S/C15H31N3O/c1-5-7-12(2)17-15(19)13(3)18(4)11-14-8-6-9-16-10-14/h12-14,16H,5-11H2,1-4H3,(H,17,19)
InChIKeyLAODFPRUOXLDEC-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.61
Rot. Bonds7

About 2-[methyl(piperidin-3-ylmethyl)amino]-N-pentan-2-ylpropanamide

2-[methyl(piperidin-3-ylmethyl)amino]-N-pentan-2-ylpropanamide (PubChem CID 106636671) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is 2-[methyl(piperidin-3-ylmethyl)amino]-N-pentan-2-ylpropanamide.

Molecular Properties

Compound Name2-[methyl(piperidin-3-ylmethyl)amino]-N-pentan-2-ylpropanamide
PubChem CID106636671
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name2-[methyl(piperidin-3-ylmethyl)amino]-N-pentan-2-ylpropanamide
SMILESCCCC(C)NC(=O)C(C)N(C)CC1CCCNC1
InChIInChI=1S/C15H31N3O/c1-5-7-12(2)17-15(19)13(3)18(4)11-14-8-6-9-16-10-14/h12-14,16H,5-11H2,1-4H3,(H,17,19)
InChIKeyLAODFPRUOXLDEC-UHFFFAOYSA-N
XLogP1.61
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
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-pentan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]propanamide
CID 106640714
2-[methyl(piperidin-3-ylmethyl)amino]-N-propylpropanamide
CID 106636555
N-cyclopentyl-2-[methyl(piperidin-3-ylmethyl)amino]propanamide
CID 106636337
2-[methyl(piperidin-3-ylmethyl)amino]-N-(2,2,2-trifluoroethyl)propanamide
CID 106636258
N-butan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]acetamide
CID 106640806
N-pentan-2-ylpiperidine-3-carboxamide
CID 18072818
2-[azetidin-3-yl(methyl)amino]-N-pentan-2-ylpropanamide
CID 66184816
N-(3-methylbutyl)-2-[piperidin-3-ylmethyl(propyl)amino]propanamide
CID 106640908
N-(piperidin-3-ylmethyl)pentan-2-amine
CID 80553041
N,2-dimethyl-N-(piperidin-3-ylmethyl)pentan-1-amine
CID 106623913
N-methyl-2-[piperidin-3-ylmethyl(propyl)amino]-N-propan-2-ylacetamide
CID 106640901
1-methoxy-N-methyl-N-(piperidin-3-ylmethyl)propan-2-amine
CID 61452791

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(piperidin-3-ylmethyl)amino]-N-pentan-2-ylpropanamide?
The IUPAC name of 2-[methyl(piperidin-3-ylmethyl)amino]-N-pentan-2-ylpropanamide (CID 106636671) is 2-[methyl(piperidin-3-ylmethyl)amino]-N-pentan-2-ylpropanamide.
What is the SMILES notation for 2-[methyl(piperidin-3-ylmethyl)amino]-N-pentan-2-ylpropanamide?
The canonical SMILES for 2-[methyl(piperidin-3-ylmethyl)amino]-N-pentan-2-ylpropanamide is CCCC(C)NC(=O)C(C)N(C)CC1CCCNC1.
What is the InChIKey of 2-[methyl(piperidin-3-ylmethyl)amino]-N-pentan-2-ylpropanamide?
The InChIKey is LAODFPRUOXLDEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-5-7-12(2)17-15(19)13(3)18(4)11-14-8-6-9-16-10-14/h12-14,16H,5-11H2,1-4H3,(H,17,19).
What are the key properties of 2-[methyl(piperidin-3-ylmethyl)amino]-N-pentan-2-ylpropanamide?
2-[methyl(piperidin-3-ylmethyl)amino]-N-pentan-2-ylpropanamide has a molecular weight of 269.43 g/mol, XLogP of 1.61, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(piperidin-3-ylmethyl)amino]-N-pentan-2-ylpropanamide is sourced from PubChem (CID 106636671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).