N-methyl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide

C14H29N3O — CID 63852599

IUPACN-methyl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide
SMILESCCCNC(C)C1CCCCN1C(C)C(=O)NC
InChIInChI=1S/C14H29N3O/c1-5-9-16-11(2)13-8-6-7-10-17(13)12(3)14(18)15-4/h11-13,16H,5-10H2,1-4H3,(H,15,18)
InChIKeyRDYHGBZPRYXZQU-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.36
Rot. Bonds6

About N-methyl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide

N-methyl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide (PubChem CID 63852599) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is N-methyl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide.

Molecular Properties

Compound NameN-methyl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide
PubChem CID63852599
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC NameN-methyl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide
SMILESCCCNC(C)C1CCCCN1C(C)C(=O)NC
InChIInChI=1S/C14H29N3O/c1-5-9-16-11(2)13-8-6-7-10-17(13)12(3)14(18)15-4/h11-13,16H,5-10H2,1-4H3,(H,15,18)
InChIKeyRDYHGBZPRYXZQU-UHFFFAOYSA-N
XLogP1.36
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide?
The IUPAC name of N-methyl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide (CID 63852599) is N-methyl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide.
What is the SMILES notation for N-methyl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide?
The canonical SMILES for N-methyl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide is CCCNC(C)C1CCCCN1C(C)C(=O)NC.
What is the InChIKey of N-methyl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide?
The InChIKey is RDYHGBZPRYXZQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-5-9-16-11(2)13-8-6-7-10-17(13)12(3)14(18)15-4/h11-13,16H,5-10H2,1-4H3,(H,15,18).
What are the key properties of N-methyl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide?
N-methyl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide has a molecular weight of 255.41 g/mol, XLogP of 1.36, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide is sourced from PubChem (CID 63852599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).