N-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]cyclopentanecarboxamide

C17H25N3O — CID 124952652

IUPACN-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]cyclopentanecarboxamide
SMILESCN(C(=O)C1CCCC1)[C@@H]1CCCN(c2ccccn2)C1
InChIInChI=1S/C17H25N3O/c1-19(17(21)14-7-2-3-8-14)15-9-6-12-20(13-15)16-10-4-5-11-18-16/h4-5,10-11,14-15H,2-3,6-9,12-13H2,1H3/t15-/m1/s1
InChIKeyDQAPWYVHBOSZOO-OAHLLOKOSA-N
MW287.41 g/mol
LogP2.70
Rot. Bonds3

About N-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]cyclopentanecarboxamide

N-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]cyclopentanecarboxamide (PubChem CID 124952652) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is N-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]cyclopentanecarboxamide
PubChem CID124952652
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC NameN-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]cyclopentanecarboxamide
SMILESCN(C(=O)C1CCCC1)[C@@H]1CCCN(c2ccccn2)C1
InChIInChI=1S/C17H25N3O/c1-19(17(21)14-7-2-3-8-14)15-9-6-12-20(13-15)16-10-4-5-11-18-16/h4-5,10-11,14-15H,2-3,6-9,12-13H2,1H3/t15-/m1/s1
InChIKeyDQAPWYVHBOSZOO-OAHLLOKOSA-N
XLogP2.70
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]cyclopentanecarboxamide?
The IUPAC name of N-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]cyclopentanecarboxamide (CID 124952652) is N-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]cyclopentanecarboxamide.
What is the SMILES notation for N-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]cyclopentanecarboxamide?
The canonical SMILES for N-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]cyclopentanecarboxamide is CN(C(=O)C1CCCC1)[C@@H]1CCCN(c2ccccn2)C1.
What is the InChIKey of N-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]cyclopentanecarboxamide?
The InChIKey is DQAPWYVHBOSZOO-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H25N3O/c1-19(17(21)14-7-2-3-8-14)15-9-6-12-20(13-15)16-10-4-5-11-18-16/h4-5,10-11,14-15H,2-3,6-9,12-13H2,1H3/t15-/m1/s1.
What are the key properties of N-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]cyclopentanecarboxamide?
N-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]cyclopentanecarboxamide has a molecular weight of 287.41 g/mol, XLogP of 2.70, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]cyclopentanecarboxamide is sourced from PubChem (CID 124952652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).