N-[1-(pyridine-4-carbonyl)piperidin-4-yl]-3-pyrrol-1-ylbutanamide

C19H24N4O2 — CID 56826392

IUPACN-[1-(pyridine-4-carbonyl)piperidin-4-yl]-3-pyrrol-1-ylbutanamide
SMILESCC(CC(=O)NC1CCN(C(=O)c2ccncc2)CC1)n1cccc1
InChIInChI=1S/C19H24N4O2/c1-15(22-10-2-3-11-22)14-18(24)21-17-6-12-23(13-7-17)19(25)16-4-8-20-9-5-16/h2-5,8-11,15,17H,6-7,12-14H2,1H3,(H,21,24)
InChIKeyWBQOTKOBLFURRQ-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.26
Rot. Bonds5

About N-[1-(pyridine-4-carbonyl)piperidin-4-yl]-3-pyrrol-1-ylbutanamide

N-[1-(pyridine-4-carbonyl)piperidin-4-yl]-3-pyrrol-1-ylbutanamide (PubChem CID 56826392) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-[1-(pyridine-4-carbonyl)piperidin-4-yl]-3-pyrrol-1-ylbutanamide.

Molecular Properties

Compound NameN-[1-(pyridine-4-carbonyl)piperidin-4-yl]-3-pyrrol-1-ylbutanamide
PubChem CID56826392
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN-[1-(pyridine-4-carbonyl)piperidin-4-yl]-3-pyrrol-1-ylbutanamide
SMILESCC(CC(=O)NC1CCN(C(=O)c2ccncc2)CC1)n1cccc1
InChIInChI=1S/C19H24N4O2/c1-15(22-10-2-3-11-22)14-18(24)21-17-6-12-23(13-7-17)19(25)16-4-8-20-9-5-16/h2-5,8-11,15,17H,6-7,12-14H2,1H3,(H,21,24)
InChIKeyWBQOTKOBLFURRQ-UHFFFAOYSA-N
XLogP2.26
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,3-dimethyl-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]butanamide
CID 110821216
4-(4-methylphenyl)-4-oxo-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]butanamide
CID 108552084
N-[1-(pyridine-4-carbonyl)piperidin-4-yl]pyridine-4-carboxamide
CID 110821209
methyl N-[1-(pyridine-4-carbonyl)piperidin-4-yl]carbamate
CID 110821211
(2R)-2-methoxy-2-phenyl-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]acetamide
CID 52512778
4-(2-methylphenoxy)-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]butanamide
CID 108553773
N-[1-(4-methoxybenzoyl)piperidin-4-yl]-3-methylbutanamide
CID 110820567
N-[1-(4-acetamidobenzoyl)piperidin-4-yl]-3-methylbutanamide
CID 110822989
N-[1-(pyridine-4-carbonyl)piperidin-4-yl]-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 154774747
3-chloro-2,2-dimethyl-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]propanamide
CID 108566693
4-oxo-N-[1-(4-pyrrol-1-ylbenzoyl)piperidin-4-yl]pentanamide
CID 108558077
4-(2-chlorophenoxy)-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]butanamide
CID 49387753

Frequently Asked Questions

What is the IUPAC name of N-[1-(pyridine-4-carbonyl)piperidin-4-yl]-3-pyrrol-1-ylbutanamide?
The IUPAC name of N-[1-(pyridine-4-carbonyl)piperidin-4-yl]-3-pyrrol-1-ylbutanamide (CID 56826392) is N-[1-(pyridine-4-carbonyl)piperidin-4-yl]-3-pyrrol-1-ylbutanamide.
What is the SMILES notation for N-[1-(pyridine-4-carbonyl)piperidin-4-yl]-3-pyrrol-1-ylbutanamide?
The canonical SMILES for N-[1-(pyridine-4-carbonyl)piperidin-4-yl]-3-pyrrol-1-ylbutanamide is CC(CC(=O)NC1CCN(C(=O)c2ccncc2)CC1)n1cccc1.
What is the InChIKey of N-[1-(pyridine-4-carbonyl)piperidin-4-yl]-3-pyrrol-1-ylbutanamide?
The InChIKey is WBQOTKOBLFURRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-15(22-10-2-3-11-22)14-18(24)21-17-6-12-23(13-7-17)19(25)16-4-8-20-9-5-16/h2-5,8-11,15,17H,6-7,12-14H2,1H3,(H,21,24).
What are the key properties of N-[1-(pyridine-4-carbonyl)piperidin-4-yl]-3-pyrrol-1-ylbutanamide?
N-[1-(pyridine-4-carbonyl)piperidin-4-yl]-3-pyrrol-1-ylbutanamide has a molecular weight of 340.43 g/mol, XLogP of 2.26, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(pyridine-4-carbonyl)piperidin-4-yl]-3-pyrrol-1-ylbutanamide is sourced from PubChem (CID 56826392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).