2-piperidin-4-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide

C17H25N3O — CID 61030185

IUPAC2-piperidin-4-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide
SMILESO=C(CC1CCNCC1)Nc1cccc(N2CCCC2)c1
InChIInChI=1S/C17H25N3O/c21-17(12-14-6-8-18-9-7-14)19-15-4-3-5-16(13-15)20-10-1-2-11-20/h3-5,13-14,18H,1-2,6-12H2,(H,19,21)
InChIKeyLDUOYCKKCBAVNH-UHFFFAOYSA-N
MW287.41 g/mol
LogP2.62
Rot. Bonds4

About 2-piperidin-4-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide

2-piperidin-4-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide (PubChem CID 61030185) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is 2-piperidin-4-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide.

Molecular Properties

Compound Name2-piperidin-4-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide
PubChem CID61030185
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC Name2-piperidin-4-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide
SMILESO=C(CC1CCNCC1)Nc1cccc(N2CCCC2)c1
InChIInChI=1S/C17H25N3O/c21-17(12-14-6-8-18-9-7-14)19-15-4-3-5-16(13-15)20-10-1-2-11-20/h3-5,13-14,18H,1-2,6-12H2,(H,19,21)
InChIKeyLDUOYCKKCBAVNH-UHFFFAOYSA-N
XLogP2.62
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(azetidin-3-yl)-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 64616785
N-(3-pyrrolidin-1-ylphenyl)piperidine-4-carboxamide
CID 60928576
2-pyrrolidin-2-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 61365428
2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 60928462
2-chloro-N-(3-piperidin-1-ylphenyl)acetamide
CID 43822445
2-amino-N-[3-(azepan-1-yl)phenyl]acetamide
CID 119892163
2-cyclobutyl-N-(4-piperazin-1-ylphenyl)acetamide
CID 103162243
3-(cyclopropylamino)-N-(3-pyrrolidin-1-ylphenyl)propanamide
CID 60926982
N-(3-nitrophenyl)-2-piperidin-4-ylacetamide
CID 119670753
2-(methylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 54862520
N-[3-[4-(cyclopropylmethyl)piperazin-1-yl]phenyl]pyrrolidine-3-carboxamide
CID 119902694
N-[3-[[2-(azepan-4-yl)acetyl]amino]phenyl]furan-3-carboxamide
CID 167785851

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-4-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide?
The IUPAC name of 2-piperidin-4-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide (CID 61030185) is 2-piperidin-4-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide.
What is the SMILES notation for 2-piperidin-4-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide?
The canonical SMILES for 2-piperidin-4-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide is O=C(CC1CCNCC1)Nc1cccc(N2CCCC2)c1.
What is the InChIKey of 2-piperidin-4-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide?
The InChIKey is LDUOYCKKCBAVNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c21-17(12-14-6-8-18-9-7-14)19-15-4-3-5-16(13-15)20-10-1-2-11-20/h3-5,13-14,18H,1-2,6-12H2,(H,19,21).
What are the key properties of 2-piperidin-4-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide?
2-piperidin-4-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide has a molecular weight of 287.41 g/mol, XLogP of 2.62, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-4-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide is sourced from PubChem (CID 61030185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).