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

C16H33N3O — CID 63852597

IUPACN-propan-2-yl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide
SMILESCCCNC(C)C1CCCCN1C(C)C(=O)NC(C)C
InChIInChI=1S/C16H33N3O/c1-6-10-17-13(4)15-9-7-8-11-19(15)14(5)16(20)18-12(2)3/h12-15,17H,6-11H2,1-5H3,(H,18,20)
InChIKeyXYBCFLPXFQNIDB-UHFFFAOYSA-N
MW283.46 g/mol
LogP2.14
Rot. Bonds7

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

N-propan-2-yl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide (PubChem CID 63852597) has the molecular formula C16H33N3O and a molecular weight of 283.46 g/mol. Its IUPAC name is N-propan-2-yl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide.

Molecular Properties

Compound NameN-propan-2-yl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide
PubChem CID63852597
Molecular FormulaC16H33N3O
Molecular Weight283.46 g/mol
Exact Mass283.26
IUPAC NameN-propan-2-yl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide
SMILESCCCNC(C)C1CCCCN1C(C)C(=O)NC(C)C
InChIInChI=1S/C16H33N3O/c1-6-10-17-13(4)15-9-7-8-11-19(15)14(5)16(20)18-12(2)3/h12-15,17H,6-11H2,1-5H3,(H,18,20)
InChIKeyXYBCFLPXFQNIDB-UHFFFAOYSA-N
XLogP2.14
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide?
The IUPAC name of N-propan-2-yl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide (CID 63852597) is N-propan-2-yl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide.
What is the SMILES notation for N-propan-2-yl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide?
The canonical SMILES for N-propan-2-yl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide is CCCNC(C)C1CCCCN1C(C)C(=O)NC(C)C.
What is the InChIKey of N-propan-2-yl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide?
The InChIKey is XYBCFLPXFQNIDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O/c1-6-10-17-13(4)15-9-7-8-11-19(15)14(5)16(20)18-12(2)3/h12-15,17H,6-11H2,1-5H3,(H,18,20).
What are the key properties of N-propan-2-yl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide?
N-propan-2-yl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide has a molecular weight of 283.46 g/mol, XLogP of 2.14, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide is sourced from PubChem (CID 63852597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).