N-cyclopentyl-3-[1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl]propanamide

C19H31N5O — CID 53188519

IUPACN-cyclopentyl-3-[1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl]propanamide
SMILESCCNc1cc(N2CCC(CCC(=O)NC3CCCC3)CC2)ncn1
InChIInChI=1S/C19H31N5O/c1-2-20-17-13-18(22-14-21-17)24-11-9-15(10-12-24)7-8-19(25)23-16-5-3-4-6-16/h13-16H,2-12H2,1H3,(H,23,25)(H,20,21,22)
InChIKeyJGYAHQOVMWIXTH-UHFFFAOYSA-N
MW345.49 g/mol
LogP2.96
Rot. Bonds7

About N-cyclopentyl-3-[1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl]propanamide

N-cyclopentyl-3-[1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl]propanamide (PubChem CID 53188519) has the molecular formula C19H31N5O and a molecular weight of 345.49 g/mol. Its IUPAC name is N-cyclopentyl-3-[1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl]propanamide.

Molecular Properties

Compound NameN-cyclopentyl-3-[1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl]propanamide
PubChem CID53188519
Molecular FormulaC19H31N5O
Molecular Weight345.49 g/mol
Exact Mass345.25
IUPAC NameN-cyclopentyl-3-[1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl]propanamide
SMILESCCNc1cc(N2CCC(CCC(=O)NC3CCCC3)CC2)ncn1
InChIInChI=1S/C19H31N5O/c1-2-20-17-13-18(22-14-21-17)24-11-9-15(10-12-24)7-8-19(25)23-16-5-3-4-6-16/h13-16H,2-12H2,1H3,(H,23,25)(H,20,21,22)
InChIKeyJGYAHQOVMWIXTH-UHFFFAOYSA-N
XLogP2.96
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.49
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-cyclopentyl-3-[1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-[1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl]propanamide?
The IUPAC name of N-cyclopentyl-3-[1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl]propanamide (CID 53188519) is N-cyclopentyl-3-[1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl]propanamide.
What is the SMILES notation for N-cyclopentyl-3-[1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl]propanamide?
The canonical SMILES for N-cyclopentyl-3-[1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl]propanamide is CCNc1cc(N2CCC(CCC(=O)NC3CCCC3)CC2)ncn1.
What is the InChIKey of N-cyclopentyl-3-[1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl]propanamide?
The InChIKey is JGYAHQOVMWIXTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N5O/c1-2-20-17-13-18(22-14-21-17)24-11-9-15(10-12-24)7-8-19(25)23-16-5-3-4-6-16/h13-16H,2-12H2,1H3,(H,23,25)(H,20,21,22).
What are the key properties of N-cyclopentyl-3-[1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl]propanamide?
N-cyclopentyl-3-[1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl]propanamide has a molecular weight of 345.49 g/mol, XLogP of 2.96, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-[1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl]propanamide is sourced from PubChem (CID 53188519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).