N-cyclopentyl-1-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-4-carboxamide

C20H31N5O — CID 53146202

IUPACN-cyclopentyl-1-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-4-carboxamide
SMILESO=C(NC1CCCC1)C1CCN(c2cnc(N3CCCCC3)nc2)CC1
InChIInChI=1S/C20H31N5O/c26-19(23-17-6-2-3-7-17)16-8-12-24(13-9-16)18-14-21-20(22-15-18)25-10-4-1-5-11-25/h14-17H,1-13H2,(H,23,26)
InChIKeyOGIZDISTMVBQCJ-UHFFFAOYSA-N
MW357.50 g/mol
LogP2.74
Rot. Bonds4

About N-cyclopentyl-1-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-4-carboxamide

N-cyclopentyl-1-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-4-carboxamide (PubChem CID 53146202) has the molecular formula C20H31N5O and a molecular weight of 357.50 g/mol. Its IUPAC name is N-cyclopentyl-1-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-4-carboxamide
PubChem CID53146202
Molecular FormulaC20H31N5O
Molecular Weight357.50 g/mol
Exact Mass357.25
IUPAC NameN-cyclopentyl-1-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-4-carboxamide
SMILESO=C(NC1CCCC1)C1CCN(c2cnc(N3CCCCC3)nc2)CC1
InChIInChI=1S/C20H31N5O/c26-19(23-17-6-2-3-7-17)16-8-12-24(13-9-16)18-14-21-20(22-15-18)25-10-4-1-5-11-25/h14-17H,1-13H2,(H,23,26)
InChIKeyOGIZDISTMVBQCJ-UHFFFAOYSA-N
XLogP2.74
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.50
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-4-carboxamide?
The IUPAC name of N-cyclopentyl-1-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-4-carboxamide (CID 53146202) is N-cyclopentyl-1-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-cyclopentyl-1-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-4-carboxamide?
The canonical SMILES for N-cyclopentyl-1-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-4-carboxamide is O=C(NC1CCCC1)C1CCN(c2cnc(N3CCCCC3)nc2)CC1.
What is the InChIKey of N-cyclopentyl-1-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-4-carboxamide?
The InChIKey is OGIZDISTMVBQCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N5O/c26-19(23-17-6-2-3-7-17)16-8-12-24(13-9-16)18-14-21-20(22-15-18)25-10-4-1-5-11-25/h14-17H,1-13H2,(H,23,26).
What are the key properties of N-cyclopentyl-1-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-4-carboxamide?
N-cyclopentyl-1-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-4-carboxamide has a molecular weight of 357.50 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-4-carboxamide is sourced from PubChem (CID 53146202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).