N-(1-cyanocyclopentyl)-2-[3-(methylamino)piperidin-1-yl]acetamide

C14H24N4O — CID 62547397

IUPACN-(1-cyanocyclopentyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
SMILESCNC1CCCN(CC(=O)NC2(C#N)CCCC2)C1
InChIInChI=1S/C14H24N4O/c1-16-12-5-4-8-18(9-12)10-13(19)17-14(11-15)6-2-3-7-14/h12,16H,2-10H2,1H3,(H,17,19)
InChIKeyRRNNJVMJZBLMIM-UHFFFAOYSA-N
MW264.37 g/mol
LogP0.62
Rot. Bonds4

About N-(1-cyanocyclopentyl)-2-[3-(methylamino)piperidin-1-yl]acetamide

N-(1-cyanocyclopentyl)-2-[3-(methylamino)piperidin-1-yl]acetamide (PubChem CID 62547397) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-(1-cyanocyclopentyl)-2-[3-(methylamino)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(1-cyanocyclopentyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
PubChem CID62547397
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-(1-cyanocyclopentyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
SMILESCNC1CCCN(CC(=O)NC2(C#N)CCCC2)C1
InChIInChI=1S/C14H24N4O/c1-16-12-5-4-8-18(9-12)10-13(19)17-14(11-15)6-2-3-7-14/h12,16H,2-10H2,1H3,(H,17,19)
InChIKeyRRNNJVMJZBLMIM-UHFFFAOYSA-N
XLogP0.62
TPSA68.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyanocyclopentyl)-2-[3-(methylamino)piperidin-1-yl]acetamide?
The IUPAC name of N-(1-cyanocyclopentyl)-2-[3-(methylamino)piperidin-1-yl]acetamide (CID 62547397) is N-(1-cyanocyclopentyl)-2-[3-(methylamino)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(1-cyanocyclopentyl)-2-[3-(methylamino)piperidin-1-yl]acetamide?
The canonical SMILES for N-(1-cyanocyclopentyl)-2-[3-(methylamino)piperidin-1-yl]acetamide is CNC1CCCN(CC(=O)NC2(C#N)CCCC2)C1.
What is the InChIKey of N-(1-cyanocyclopentyl)-2-[3-(methylamino)piperidin-1-yl]acetamide?
The InChIKey is RRNNJVMJZBLMIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-16-12-5-4-8-18(9-12)10-13(19)17-14(11-15)6-2-3-7-14/h12,16H,2-10H2,1H3,(H,17,19).
What are the key properties of N-(1-cyanocyclopentyl)-2-[3-(methylamino)piperidin-1-yl]acetamide?
N-(1-cyanocyclopentyl)-2-[3-(methylamino)piperidin-1-yl]acetamide has a molecular weight of 264.37 g/mol, XLogP of 0.62, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyanocyclopentyl)-2-[3-(methylamino)piperidin-1-yl]acetamide is sourced from PubChem (CID 62547397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).