N-(2,2-dimethylcyclopentyl)-2-methyl-2-piperazin-1-ylpropanamide

C15H29N3O — CID 80551079

IUPACN-(2,2-dimethylcyclopentyl)-2-methyl-2-piperazin-1-ylpropanamide
SMILESCC1(C)CCCC1NC(=O)C(C)(C)N1CCNCC1
InChIInChI=1S/C15H29N3O/c1-14(2)7-5-6-12(14)17-13(19)15(3,4)18-10-8-16-9-11-18/h12,16H,5-11H2,1-4H3,(H,17,19)
InChIKeySRAKKDNEYDGUJM-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.37
Rot. Bonds3

About N-(2,2-dimethylcyclopentyl)-2-methyl-2-piperazin-1-ylpropanamide

N-(2,2-dimethylcyclopentyl)-2-methyl-2-piperazin-1-ylpropanamide (PubChem CID 80551079) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is N-(2,2-dimethylcyclopentyl)-2-methyl-2-piperazin-1-ylpropanamide.

Molecular Properties

Compound NameN-(2,2-dimethylcyclopentyl)-2-methyl-2-piperazin-1-ylpropanamide
PubChem CID80551079
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC NameN-(2,2-dimethylcyclopentyl)-2-methyl-2-piperazin-1-ylpropanamide
SMILESCC1(C)CCCC1NC(=O)C(C)(C)N1CCNCC1
InChIInChI=1S/C15H29N3O/c1-14(2)7-5-6-12(14)17-13(19)15(3,4)18-10-8-16-9-11-18/h12,16H,5-11H2,1-4H3,(H,17,19)
InChIKeySRAKKDNEYDGUJM-UHFFFAOYSA-N
XLogP1.37
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylcyclopentyl)-2-methyl-2-piperazin-1-ylpropanamide?
The IUPAC name of N-(2,2-dimethylcyclopentyl)-2-methyl-2-piperazin-1-ylpropanamide (CID 80551079) is N-(2,2-dimethylcyclopentyl)-2-methyl-2-piperazin-1-ylpropanamide.
What is the SMILES notation for N-(2,2-dimethylcyclopentyl)-2-methyl-2-piperazin-1-ylpropanamide?
The canonical SMILES for N-(2,2-dimethylcyclopentyl)-2-methyl-2-piperazin-1-ylpropanamide is CC1(C)CCCC1NC(=O)C(C)(C)N1CCNCC1.
What is the InChIKey of N-(2,2-dimethylcyclopentyl)-2-methyl-2-piperazin-1-ylpropanamide?
The InChIKey is SRAKKDNEYDGUJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-14(2)7-5-6-12(14)17-13(19)15(3,4)18-10-8-16-9-11-18/h12,16H,5-11H2,1-4H3,(H,17,19).
What are the key properties of N-(2,2-dimethylcyclopentyl)-2-methyl-2-piperazin-1-ylpropanamide?
N-(2,2-dimethylcyclopentyl)-2-methyl-2-piperazin-1-ylpropanamide has a molecular weight of 267.42 g/mol, XLogP of 1.37, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylcyclopentyl)-2-methyl-2-piperazin-1-ylpropanamide is sourced from PubChem (CID 80551079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).