N,2-dimethyl-3-(methylamino)-N-(1-propylpiperidin-4-yl)propanamide

C14H29N3O — CID 79201989

IUPACN,2-dimethyl-3-(methylamino)-N-(1-propylpiperidin-4-yl)propanamide
SMILESCCCN1CCC(N(C)C(=O)C(C)CNC)CC1
InChIInChI=1S/C14H29N3O/c1-5-8-17-9-6-13(7-10-17)16(4)14(18)12(2)11-15-3/h12-13,15H,5-11H2,1-4H3
InChIKeyCFZAFGSXBUWYRU-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.17
Rot. Bonds6

About N,2-dimethyl-3-(methylamino)-N-(1-propylpiperidin-4-yl)propanamide

N,2-dimethyl-3-(methylamino)-N-(1-propylpiperidin-4-yl)propanamide (PubChem CID 79201989) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is N,2-dimethyl-3-(methylamino)-N-(1-propylpiperidin-4-yl)propanamide.

Molecular Properties

Compound NameN,2-dimethyl-3-(methylamino)-N-(1-propylpiperidin-4-yl)propanamide
PubChem CID79201989
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC NameN,2-dimethyl-3-(methylamino)-N-(1-propylpiperidin-4-yl)propanamide
SMILESCCCN1CCC(N(C)C(=O)C(C)CNC)CC1
InChIInChI=1S/C14H29N3O/c1-5-8-17-9-6-13(7-10-17)16(4)14(18)12(2)11-15-3/h12-13,15H,5-11H2,1-4H3
InChIKeyCFZAFGSXBUWYRU-UHFFFAOYSA-N
XLogP1.17
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-3-(methylamino)-N-(1-propylpiperidin-4-yl)propanamide?
The IUPAC name of N,2-dimethyl-3-(methylamino)-N-(1-propylpiperidin-4-yl)propanamide (CID 79201989) is N,2-dimethyl-3-(methylamino)-N-(1-propylpiperidin-4-yl)propanamide.
What is the SMILES notation for N,2-dimethyl-3-(methylamino)-N-(1-propylpiperidin-4-yl)propanamide?
The canonical SMILES for N,2-dimethyl-3-(methylamino)-N-(1-propylpiperidin-4-yl)propanamide is CCCN1CCC(N(C)C(=O)C(C)CNC)CC1.
What is the InChIKey of N,2-dimethyl-3-(methylamino)-N-(1-propylpiperidin-4-yl)propanamide?
The InChIKey is CFZAFGSXBUWYRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-5-8-17-9-6-13(7-10-17)16(4)14(18)12(2)11-15-3/h12-13,15H,5-11H2,1-4H3.
What are the key properties of N,2-dimethyl-3-(methylamino)-N-(1-propylpiperidin-4-yl)propanamide?
N,2-dimethyl-3-(methylamino)-N-(1-propylpiperidin-4-yl)propanamide has a molecular weight of 255.41 g/mol, XLogP of 1.17, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-3-(methylamino)-N-(1-propylpiperidin-4-yl)propanamide is sourced from PubChem (CID 79201989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).