N-(cyclopentylmethyl)-2-(1-methylpiperazin-2-yl)acetamide

C13H25N3O — CID 115178411

IUPACN-(cyclopentylmethyl)-2-(1-methylpiperazin-2-yl)acetamide
SMILESCN1CCNCC1CC(=O)NCC1CCCC1
InChIInChI=1S/C13H25N3O/c1-16-7-6-14-10-12(16)8-13(17)15-9-11-4-2-3-5-11/h11-12,14H,2-10H2,1H3,(H,15,17)
InChIKeyUXZJRBFEHJIVEV-UHFFFAOYSA-N
MW239.36 g/mol
LogP0.59
Rot. Bonds4

About N-(cyclopentylmethyl)-2-(1-methylpiperazin-2-yl)acetamide

N-(cyclopentylmethyl)-2-(1-methylpiperazin-2-yl)acetamide (PubChem CID 115178411) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-2-(1-methylpiperazin-2-yl)acetamide.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-2-(1-methylpiperazin-2-yl)acetamide
PubChem CID115178411
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC NameN-(cyclopentylmethyl)-2-(1-methylpiperazin-2-yl)acetamide
SMILESCN1CCNCC1CC(=O)NCC1CCCC1
InChIInChI=1S/C13H25N3O/c1-16-7-6-14-10-12(16)8-13(17)15-9-11-4-2-3-5-11/h11-12,14H,2-10H2,1H3,(H,15,17)
InChIKeyUXZJRBFEHJIVEV-UHFFFAOYSA-N
XLogP0.59
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopentyl-N-[(1-methylpiperazin-2-yl)methyl]methanamine
CID 115238393
2-(1-methylpiperazin-2-yl)-N-[2-(oxan-4-yl)ethyl]acetamide
CID 115178445
N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-piperidin-3-ylacetamide
CID 63897115
2-(azetidin-3-yl)-N-(cyclohexylmethyl)acetamide
CID 64615957
1-cyclobutyl-2-(1-methylpiperazin-2-yl)ethanone
CID 116920123
2-(1-methylpiperidin-3-yl)-N-(pyrrolidin-3-ylmethyl)acetamide
CID 115271888
N-[(1-methylpiperazin-2-yl)methyl]-1-(oxan-4-yl)methanamine
CID 115238395
2-cycloheptyl-N-(piperidin-4-ylmethyl)acetamide
CID 115736681
3-methyl-1-(1-methylpiperazin-2-yl)butan-2-one
CID 116920060
N-(cyclobutylmethyl)-2-piperazin-1-ylacetamide
CID 43298878
N-(cyclohexylmethyl)-2-(pyrrolidin-3-ylamino)acetamide
CID 143248684
N-[(1-ethylpyrrolidin-3-yl)methyl]-2-piperidin-3-ylacetamide
CID 62690196

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-2-(1-methylpiperazin-2-yl)acetamide?
The IUPAC name of N-(cyclopentylmethyl)-2-(1-methylpiperazin-2-yl)acetamide (CID 115178411) is N-(cyclopentylmethyl)-2-(1-methylpiperazin-2-yl)acetamide.
What is the SMILES notation for N-(cyclopentylmethyl)-2-(1-methylpiperazin-2-yl)acetamide?
The canonical SMILES for N-(cyclopentylmethyl)-2-(1-methylpiperazin-2-yl)acetamide is CN1CCNCC1CC(=O)NCC1CCCC1.
What is the InChIKey of N-(cyclopentylmethyl)-2-(1-methylpiperazin-2-yl)acetamide?
The InChIKey is UXZJRBFEHJIVEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-16-7-6-14-10-12(16)8-13(17)15-9-11-4-2-3-5-11/h11-12,14H,2-10H2,1H3,(H,15,17).
What are the key properties of N-(cyclopentylmethyl)-2-(1-methylpiperazin-2-yl)acetamide?
N-(cyclopentylmethyl)-2-(1-methylpiperazin-2-yl)acetamide has a molecular weight of 239.36 g/mol, XLogP of 0.59, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-2-(1-methylpiperazin-2-yl)acetamide is sourced from PubChem (CID 115178411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).