N-(cyclopenten-1-yl)-N-methyl-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)acetamide

C16H27N3O — CID 62274435

IUPACN-(cyclopenten-1-yl)-N-methyl-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)acetamide
SMILESCN(C(=O)CN1CCCC1C1CCCN1)C1=CCCC1
InChIInChI=1S/C16H27N3O/c1-18(13-6-2-3-7-13)16(20)12-19-11-5-9-15(19)14-8-4-10-17-14/h6,14-15,17H,2-5,7-12H2,1H3
InChIKeyKHPXSBGSBCMKOZ-UHFFFAOYSA-N
MW277.41 g/mol
LogP1.73
Rot. Bonds4

About N-(cyclopenten-1-yl)-N-methyl-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)acetamide

N-(cyclopenten-1-yl)-N-methyl-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)acetamide (PubChem CID 62274435) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is N-(cyclopenten-1-yl)-N-methyl-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(cyclopenten-1-yl)-N-methyl-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)acetamide
PubChem CID62274435
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC NameN-(cyclopenten-1-yl)-N-methyl-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)acetamide
SMILESCN(C(=O)CN1CCCC1C1CCCN1)C1=CCCC1
InChIInChI=1S/C16H27N3O/c1-18(13-6-2-3-7-13)16(20)12-19-11-5-9-15(19)14-8-4-10-17-14/h6,14-15,17H,2-5,7-12H2,1H3
InChIKeyKHPXSBGSBCMKOZ-UHFFFAOYSA-N
XLogP1.73
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopenten-1-yl)-N-methyl-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)acetamide?
The IUPAC name of N-(cyclopenten-1-yl)-N-methyl-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)acetamide (CID 62274435) is N-(cyclopenten-1-yl)-N-methyl-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)acetamide.
What is the SMILES notation for N-(cyclopenten-1-yl)-N-methyl-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)acetamide?
The canonical SMILES for N-(cyclopenten-1-yl)-N-methyl-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)acetamide is CN(C(=O)CN1CCCC1C1CCCN1)C1=CCCC1.
What is the InChIKey of N-(cyclopenten-1-yl)-N-methyl-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)acetamide?
The InChIKey is KHPXSBGSBCMKOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-18(13-6-2-3-7-13)16(20)12-19-11-5-9-15(19)14-8-4-10-17-14/h6,14-15,17H,2-5,7-12H2,1H3.
What are the key properties of N-(cyclopenten-1-yl)-N-methyl-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)acetamide?
N-(cyclopenten-1-yl)-N-methyl-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)acetamide has a molecular weight of 277.41 g/mol, XLogP of 1.73, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopenten-1-yl)-N-methyl-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)acetamide is sourced from PubChem (CID 62274435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).