2-[ethyl(pyrrolidin-3-yl)amino]-N-(6-methylheptan-2-yl)acetamide

C16H33N3O — CID 63299866

IUPAC2-[ethyl(pyrrolidin-3-yl)amino]-N-(6-methylheptan-2-yl)acetamide
SMILESCCN(CC(=O)NC(C)CCCC(C)C)C1CCNC1
InChIInChI=1S/C16H33N3O/c1-5-19(15-9-10-17-11-15)12-16(20)18-14(4)8-6-7-13(2)3/h13-15,17H,5-12H2,1-4H3,(H,18,20)
InChIKeyMDGUGBOSGCAUNJ-UHFFFAOYSA-N
MW283.46 g/mol
LogP2.00
Rot. Bonds9

About 2-[ethyl(pyrrolidin-3-yl)amino]-N-(6-methylheptan-2-yl)acetamide

2-[ethyl(pyrrolidin-3-yl)amino]-N-(6-methylheptan-2-yl)acetamide (PubChem CID 63299866) has the molecular formula C16H33N3O and a molecular weight of 283.46 g/mol. Its IUPAC name is 2-[ethyl(pyrrolidin-3-yl)amino]-N-(6-methylheptan-2-yl)acetamide.

Molecular Properties

Compound Name2-[ethyl(pyrrolidin-3-yl)amino]-N-(6-methylheptan-2-yl)acetamide
PubChem CID63299866
Molecular FormulaC16H33N3O
Molecular Weight283.46 g/mol
Exact Mass283.26
IUPAC Name2-[ethyl(pyrrolidin-3-yl)amino]-N-(6-methylheptan-2-yl)acetamide
SMILESCCN(CC(=O)NC(C)CCCC(C)C)C1CCNC1
InChIInChI=1S/C16H33N3O/c1-5-19(15-9-10-17-11-15)12-16(20)18-14(4)8-6-7-13(2)3/h13-15,17H,5-12H2,1-4H3,(H,18,20)
InChIKeyMDGUGBOSGCAUNJ-UHFFFAOYSA-N
XLogP2.00
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-2-[ethyl(pyrrolidin-3-yl)amino]acetamide
CID 63300316
2-[ethyl(pyrrolidin-3-yl)amino]-N-pentan-3-ylacetamide
CID 63300371
N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide
CID 60805793
N-butyl-2-[ethyl(pyrrolidin-3-yl)amino]acetamide
CID 63300417
N-propan-2-yl-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119921653
2-[azepan-4-yl(ethyl)amino]-N-propan-2-ylacetamide
CID 103983310
N-(2-cyano-3-methylbutan-2-yl)-2-[ethyl(pyrrolidin-3-yl)amino]acetamide
CID 55206294
N-(2-methylpropyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119921772
ethyl 2-[ethyl(pyrrolidin-3-yl)amino]acetate
CID 63300317
N-(6-methylheptan-2-yl)piperidine-3-carboxamide;hydrochloride
CID 119262989
N-butyl-2-[ethyl(piperidin-3-yl)amino]acetamide
CID 55245115
N-cyclohexyl-2-[ethyl(pyrrolidin-3-yl)amino]-N-propan-2-ylacetamide
CID 63299179

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(pyrrolidin-3-yl)amino]-N-(6-methylheptan-2-yl)acetamide?
The IUPAC name of 2-[ethyl(pyrrolidin-3-yl)amino]-N-(6-methylheptan-2-yl)acetamide (CID 63299866) is 2-[ethyl(pyrrolidin-3-yl)amino]-N-(6-methylheptan-2-yl)acetamide.
What is the SMILES notation for 2-[ethyl(pyrrolidin-3-yl)amino]-N-(6-methylheptan-2-yl)acetamide?
The canonical SMILES for 2-[ethyl(pyrrolidin-3-yl)amino]-N-(6-methylheptan-2-yl)acetamide is CCN(CC(=O)NC(C)CCCC(C)C)C1CCNC1.
What is the InChIKey of 2-[ethyl(pyrrolidin-3-yl)amino]-N-(6-methylheptan-2-yl)acetamide?
The InChIKey is MDGUGBOSGCAUNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O/c1-5-19(15-9-10-17-11-15)12-16(20)18-14(4)8-6-7-13(2)3/h13-15,17H,5-12H2,1-4H3,(H,18,20).
What are the key properties of 2-[ethyl(pyrrolidin-3-yl)amino]-N-(6-methylheptan-2-yl)acetamide?
2-[ethyl(pyrrolidin-3-yl)amino]-N-(6-methylheptan-2-yl)acetamide has a molecular weight of 283.46 g/mol, XLogP of 2.00, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(pyrrolidin-3-yl)amino]-N-(6-methylheptan-2-yl)acetamide is sourced from PubChem (CID 63299866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).