N-[1-[(3R)-1-[2-(diethylamino)ethyl]pyrrolidin-3-yl]pyrazol-3-yl]acetamide

C15H27N5O — CID 129341818

IUPACN-[1-[(3R)-1-[2-(diethylamino)ethyl]pyrrolidin-3-yl]pyrazol-3-yl]acetamide
SMILESCCN(CC)CCN1CC[C@@H](n2ccc(NC(C)=O)n2)C1
InChIInChI=1S/C15H27N5O/c1-4-18(5-2)10-11-19-8-6-14(12-19)20-9-7-15(17-20)16-13(3)21/h7,9,14H,4-6,8,10-12H2,1-3H3,(H,16,17,21)/t14-/m1/s1
InChIKeyZJGUPTJMYZYVJQ-CQSZACIVSA-N
MW293.41 g/mol
LogP1.43
Rot. Bonds7

About N-[1-[(3R)-1-[2-(diethylamino)ethyl]pyrrolidin-3-yl]pyrazol-3-yl]acetamide

N-[1-[(3R)-1-[2-(diethylamino)ethyl]pyrrolidin-3-yl]pyrazol-3-yl]acetamide (PubChem CID 129341818) has the molecular formula C15H27N5O and a molecular weight of 293.41 g/mol. Its IUPAC name is N-[1-[(3R)-1-[2-(diethylamino)ethyl]pyrrolidin-3-yl]pyrazol-3-yl]acetamide.

Molecular Properties

Compound NameN-[1-[(3R)-1-[2-(diethylamino)ethyl]pyrrolidin-3-yl]pyrazol-3-yl]acetamide
PubChem CID129341818
Molecular FormulaC15H27N5O
Molecular Weight293.41 g/mol
Exact Mass293.22
IUPAC NameN-[1-[(3R)-1-[2-(diethylamino)ethyl]pyrrolidin-3-yl]pyrazol-3-yl]acetamide
SMILESCCN(CC)CCN1CC[C@@H](n2ccc(NC(C)=O)n2)C1
InChIInChI=1S/C15H27N5O/c1-4-18(5-2)10-11-19-8-6-14(12-19)20-9-7-15(17-20)16-13(3)21/h7,9,14H,4-6,8,10-12H2,1-3H3,(H,16,17,21)/t14-/m1/s1
InChIKeyZJGUPTJMYZYVJQ-CQSZACIVSA-N
XLogP1.43
TPSA53.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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N-[1-[1-[(5-methylfuran-2-yl)methyl]pyrrolidin-3-yl]pyrazol-3-yl]acetamide
CID 129006730
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N-[1-[(3S)-1-[(2R)-2-ethoxypropanoyl]pyrrolidin-3-yl]pyrazol-3-yl]acetamide
CID 129327404
N-[1-[(3S)-1-[(2S)-2-ethoxypropanoyl]pyrrolidin-3-yl]pyrazol-3-yl]acetamide
CID 129327403
N-[1-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]pyrazol-3-yl]acetamide
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Frequently Asked Questions

What is the IUPAC name of N-[1-[(3R)-1-[2-(diethylamino)ethyl]pyrrolidin-3-yl]pyrazol-3-yl]acetamide?
The IUPAC name of N-[1-[(3R)-1-[2-(diethylamino)ethyl]pyrrolidin-3-yl]pyrazol-3-yl]acetamide (CID 129341818) is N-[1-[(3R)-1-[2-(diethylamino)ethyl]pyrrolidin-3-yl]pyrazol-3-yl]acetamide.
What is the SMILES notation for N-[1-[(3R)-1-[2-(diethylamino)ethyl]pyrrolidin-3-yl]pyrazol-3-yl]acetamide?
The canonical SMILES for N-[1-[(3R)-1-[2-(diethylamino)ethyl]pyrrolidin-3-yl]pyrazol-3-yl]acetamide is CCN(CC)CCN1CC[C@@H](n2ccc(NC(C)=O)n2)C1.
What is the InChIKey of N-[1-[(3R)-1-[2-(diethylamino)ethyl]pyrrolidin-3-yl]pyrazol-3-yl]acetamide?
The InChIKey is ZJGUPTJMYZYVJQ-CQSZACIVSA-N. The full InChI is InChI=1S/C15H27N5O/c1-4-18(5-2)10-11-19-8-6-14(12-19)20-9-7-15(17-20)16-13(3)21/h7,9,14H,4-6,8,10-12H2,1-3H3,(H,16,17,21)/t14-/m1/s1.
What are the key properties of N-[1-[(3R)-1-[2-(diethylamino)ethyl]pyrrolidin-3-yl]pyrazol-3-yl]acetamide?
N-[1-[(3R)-1-[2-(diethylamino)ethyl]pyrrolidin-3-yl]pyrazol-3-yl]acetamide has a molecular weight of 293.41 g/mol, XLogP of 1.43, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(3R)-1-[2-(diethylamino)ethyl]pyrrolidin-3-yl]pyrazol-3-yl]acetamide is sourced from PubChem (CID 129341818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).