N-[1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)pyrrolidin-3-yl]acetamide

C11H22N4O2 — CID 113402653

IUPACN-[1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)pyrrolidin-3-yl]acetamide
SMILESCC(=O)NC1CCN(CC(C)(C)C(=O)NN)C1
InChIInChI=1S/C11H22N4O2/c1-8(16)13-9-4-5-15(6-9)7-11(2,3)10(17)14-12/h9H,4-7,12H2,1-3H3,(H,13,16)(H,14,17)
InChIKeyCVCPPYPMSJFOCY-UHFFFAOYSA-N
MW242.32 g/mol
LogP-0.79
Rot. Bonds4

About N-[1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)pyrrolidin-3-yl]acetamide

N-[1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)pyrrolidin-3-yl]acetamide (PubChem CID 113402653) has the molecular formula C11H22N4O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is N-[1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)pyrrolidin-3-yl]acetamide.

Molecular Properties

Compound NameN-[1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)pyrrolidin-3-yl]acetamide
PubChem CID113402653
Molecular FormulaC11H22N4O2
Molecular Weight242.32 g/mol
Exact Mass242.17
IUPAC NameN-[1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)pyrrolidin-3-yl]acetamide
SMILESCC(=O)NC1CCN(CC(C)(C)C(=O)NN)C1
InChIInChI=1S/C11H22N4O2/c1-8(16)13-9-4-5-15(6-9)7-11(2,3)10(17)14-12/h9H,4-7,12H2,1-3H3,(H,13,16)(H,14,17)
InChIKeyCVCPPYPMSJFOCY-UHFFFAOYSA-N
XLogP-0.79
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 5-0.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(3R)-1-(2,2-dimethylpropyl)pyrrolidin-3-yl]acetamide
CID 58877738
N-[1-(2-aminoethyl)pyrrolidin-3-yl]acetamide
CID 23450282
N-[1-(2,2,2-trifluoroethyl)piperidin-3-yl]acetamide
CID 126774083
N-[1-(2-oxopropyl)pyrrolidin-3-yl]acetamide
CID 58937983
3-(3,4-dimethylpyrrolidin-1-yl)-2,2-dimethylpropanehydrazide
CID 79631732
1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)piperidine-3-carboxamide
CID 79628715
2,2-dimethyl-3-(4-propan-2-ylazepan-1-yl)propanehydrazide
CID 79631643
2,2-dimethyl-3-(4-methylazepan-1-yl)propanehydrazide
CID 79630412
2-(3-acetamidopyrrolidin-1-yl)acetic acid
CID 66567726
3-[4-(cyclopropylmethyl)piperazin-1-yl]-2,2-dimethylpropanehydrazide
CID 79631258
3-(azocan-1-yl)-2,2-dimethylpropanehydrazide
CID 79627677
N-[1-(4-amino-2,2-dimethylbutyl)piperidin-4-yl]acetamide
CID 144757888

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)pyrrolidin-3-yl]acetamide?
The IUPAC name of N-[1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)pyrrolidin-3-yl]acetamide (CID 113402653) is N-[1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)pyrrolidin-3-yl]acetamide.
What is the SMILES notation for N-[1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)pyrrolidin-3-yl]acetamide?
The canonical SMILES for N-[1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)pyrrolidin-3-yl]acetamide is CC(=O)NC1CCN(CC(C)(C)C(=O)NN)C1.
What is the InChIKey of N-[1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)pyrrolidin-3-yl]acetamide?
The InChIKey is CVCPPYPMSJFOCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O2/c1-8(16)13-9-4-5-15(6-9)7-11(2,3)10(17)14-12/h9H,4-7,12H2,1-3H3,(H,13,16)(H,14,17).
What are the key properties of N-[1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)pyrrolidin-3-yl]acetamide?
N-[1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)pyrrolidin-3-yl]acetamide has a molecular weight of 242.32 g/mol, XLogP of -0.79, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)pyrrolidin-3-yl]acetamide is sourced from PubChem (CID 113402653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).