N-(methylcarbamoyl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide

C13H21N5O2 — CID 51104649

IUPACN-(methylcarbamoyl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide
SMILESCNC(=O)NC(=O)CCN1CCC(c2ccn[nH]2)CC1
InChIInChI=1S/C13H21N5O2/c1-14-13(20)16-12(19)5-9-18-7-3-10(4-8-18)11-2-6-15-17-11/h2,6,10H,3-5,7-9H2,1H3,(H,15,17)(H2,14,16,19,20)
InChIKeyWTDYSPSNQHOLHN-UHFFFAOYSA-N
MW279.34 g/mol
LogP0.43
Rot. Bonds4

About N-(methylcarbamoyl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide

N-(methylcarbamoyl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide (PubChem CID 51104649) has the molecular formula C13H21N5O2 and a molecular weight of 279.34 g/mol. Its IUPAC name is N-(methylcarbamoyl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide.

Molecular Properties

Compound NameN-(methylcarbamoyl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide
PubChem CID51104649
Molecular FormulaC13H21N5O2
Molecular Weight279.34 g/mol
Exact Mass279.17
IUPAC NameN-(methylcarbamoyl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide
SMILESCNC(=O)NC(=O)CCN1CCC(c2ccn[nH]2)CC1
InChIInChI=1S/C13H21N5O2/c1-14-13(20)16-12(19)5-9-18-7-3-10(4-8-18)11-2-6-15-17-11/h2,6,10H,3-5,7-9H2,1H3,(H,15,17)(H2,14,16,19,20)
InChIKeyWTDYSPSNQHOLHN-UHFFFAOYSA-N
XLogP0.43
TPSA90.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 50.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(methylcarbamoyl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-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-(methylcarbamoyl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide?
The IUPAC name of N-(methylcarbamoyl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide (CID 51104649) is N-(methylcarbamoyl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide.
What is the SMILES notation for N-(methylcarbamoyl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide?
The canonical SMILES for N-(methylcarbamoyl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide is CNC(=O)NC(=O)CCN1CCC(c2ccn[nH]2)CC1.
What is the InChIKey of N-(methylcarbamoyl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide?
The InChIKey is WTDYSPSNQHOLHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O2/c1-14-13(20)16-12(19)5-9-18-7-3-10(4-8-18)11-2-6-15-17-11/h2,6,10H,3-5,7-9H2,1H3,(H,15,17)(H2,14,16,19,20).
What are the key properties of N-(methylcarbamoyl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide?
N-(methylcarbamoyl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide has a molecular weight of 279.34 g/mol, XLogP of 0.43, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(methylcarbamoyl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide is sourced from PubChem (CID 51104649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).