N-cyclopropyl-2-[(3S)-3-pyrrolidin-1-ylpiperidin-1-yl]acetamide

C14H25N3O — CID 95576047

IUPACN-cyclopropyl-2-[(3S)-3-pyrrolidin-1-ylpiperidin-1-yl]acetamide
SMILESO=C(CN1CCC[C@H](N2CCCC2)C1)NC1CC1
InChIInChI=1S/C14H25N3O/c18-14(15-12-5-6-12)11-16-7-3-4-13(10-16)17-8-1-2-9-17/h12-13H,1-11H2,(H,15,18)/t13-/m0/s1
InChIKeyCWFNTGYHHGOYTB-ZDUSSCGKSA-N
MW251.37 g/mol
LogP0.83
Rot. Bonds4

About N-cyclopropyl-2-[(3S)-3-pyrrolidin-1-ylpiperidin-1-yl]acetamide

N-cyclopropyl-2-[(3S)-3-pyrrolidin-1-ylpiperidin-1-yl]acetamide (PubChem CID 95576047) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is N-cyclopropyl-2-[(3S)-3-pyrrolidin-1-ylpiperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(3S)-3-pyrrolidin-1-ylpiperidin-1-yl]acetamide
PubChem CID95576047
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC NameN-cyclopropyl-2-[(3S)-3-pyrrolidin-1-ylpiperidin-1-yl]acetamide
SMILESO=C(CN1CCC[C@H](N2CCCC2)C1)NC1CC1
InChIInChI=1S/C14H25N3O/c18-14(15-12-5-6-12)11-16-7-3-4-13(10-16)17-8-1-2-9-17/h12-13H,1-11H2,(H,15,18)/t13-/m0/s1
InChIKeyCWFNTGYHHGOYTB-ZDUSSCGKSA-N
XLogP0.83
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(8aR)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-N-cyclopropylacetamide
CID 51618982
2-[(3R)-3-(azepan-1-yl)piperidin-1-yl]-N-propan-2-ylacetamide
CID 95354060
2-[(3R)-3-(azepan-1-yl)piperidin-1-yl]-N-(cyclopropylmethyl)acetamide
CID 97080531
N-cyclopropyl-2-(4-hydroxy-3-methylpiperidin-1-yl)acetamide
CID 114502743
N-cyclohexyl-2-[(3S)-3-hydroxypiperidin-1-yl]acetamide
CID 107225773
N-[1-[2-(cyclopentylamino)-2-oxoethyl]piperidin-3-yl]cyclobutanecarboxamide
CID 171335040
2-(3-acetylpiperidin-1-yl)-N-cyclohexylacetamide
CID 55256614
2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopentylacetamide;hydrochloride
CID 119915633
1-[2-(cyclopropylamino)-2-oxoethyl]pyrrolidine-3-carboxylic acid
CID 63030850
N-cyclooctyl-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride
CID 119918786
N-cyclohexyl-2-(3-piperazin-1-ylazetidin-1-yl)acetamide
CID 66196372
N-cyclopropyl-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]acetamide
CID 63854794

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(3S)-3-pyrrolidin-1-ylpiperidin-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-2-[(3S)-3-pyrrolidin-1-ylpiperidin-1-yl]acetamide (CID 95576047) is N-cyclopropyl-2-[(3S)-3-pyrrolidin-1-ylpiperidin-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[(3S)-3-pyrrolidin-1-ylpiperidin-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[(3S)-3-pyrrolidin-1-ylpiperidin-1-yl]acetamide is O=C(CN1CCC[C@H](N2CCCC2)C1)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[(3S)-3-pyrrolidin-1-ylpiperidin-1-yl]acetamide?
The InChIKey is CWFNTGYHHGOYTB-ZDUSSCGKSA-N. The full InChI is InChI=1S/C14H25N3O/c18-14(15-12-5-6-12)11-16-7-3-4-13(10-16)17-8-1-2-9-17/h12-13H,1-11H2,(H,15,18)/t13-/m0/s1.
What are the key properties of N-cyclopropyl-2-[(3S)-3-pyrrolidin-1-ylpiperidin-1-yl]acetamide?
N-cyclopropyl-2-[(3S)-3-pyrrolidin-1-ylpiperidin-1-yl]acetamide has a molecular weight of 251.37 g/mol, XLogP of 0.83, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(3S)-3-pyrrolidin-1-ylpiperidin-1-yl]acetamide is sourced from PubChem (CID 95576047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).