N-[(3R)-1-(2-pyridin-4-ylacetyl)piperidin-3-yl]propanamide

C15H21N3O2 — CID 95635726

IUPACN-[(3R)-1-(2-pyridin-4-ylacetyl)piperidin-3-yl]propanamide
SMILESCCC(=O)N[C@@H]1CCCN(C(=O)Cc2ccncc2)C1
InChIInChI=1S/C15H21N3O2/c1-2-14(19)17-13-4-3-9-18(11-13)15(20)10-12-5-7-16-8-6-12/h5-8,13H,2-4,9-11H2,1H3,(H,17,19)/t13-/m1/s1
InChIKeyHFLMJEUBHQNMIC-CYBMUJFWSA-N
MW275.35 g/mol
LogP1.14
Rot. Bonds4

About N-[(3R)-1-(2-pyridin-4-ylacetyl)piperidin-3-yl]propanamide

N-[(3R)-1-(2-pyridin-4-ylacetyl)piperidin-3-yl]propanamide (PubChem CID 95635726) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is N-[(3R)-1-(2-pyridin-4-ylacetyl)piperidin-3-yl]propanamide.

Molecular Properties

Compound NameN-[(3R)-1-(2-pyridin-4-ylacetyl)piperidin-3-yl]propanamide
PubChem CID95635726
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC NameN-[(3R)-1-(2-pyridin-4-ylacetyl)piperidin-3-yl]propanamide
SMILESCCC(=O)N[C@@H]1CCCN(C(=O)Cc2ccncc2)C1
InChIInChI=1S/C15H21N3O2/c1-2-14(19)17-13-4-3-9-18(11-13)15(20)10-12-5-7-16-8-6-12/h5-8,13H,2-4,9-11H2,1H3,(H,17,19)/t13-/m1/s1
InChIKeyHFLMJEUBHQNMIC-CYBMUJFWSA-N
XLogP1.14
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2-pyridin-4-ylacetyl)piperidin-3-yl]propanamide
CID 56795097
N-[1-[2-(4-aminophenyl)acetyl]piperidin-3-yl]butanamide
CID 119761681
1-(3-aminopiperidin-1-yl)-2-pyridin-4-ylethanone
CID 61297761
2-methyl-N-[1-(2-phenylacetyl)piperidin-3-yl]propanamide
CID 127187955
ethyl (3S)-1-(2-pyridin-4-ylacetyl)piperidine-3-carboxylate
CID 115535618
ethyl 1-(2-pyridin-4-ylacetyl)piperidine-3-carboxylate
CID 43623395
N-[1-(2-phenylacetyl)piperidin-4-yl]propanamide
CID 110820721
1-[(3S)-3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-2-pyridin-4-ylethanone
CID 97131606
1-[(3S)-3-(2-hydroxypropan-2-yl)pyrrolidin-1-yl]-2-pyridin-4-ylethanone
CID 99929054
1-[3-(methylamino)piperidin-1-yl]-2-[4-(2-methylpropyl)phenyl]ethanone
CID 119491030
1-[3-(methylamino)piperidin-1-yl]-2-[4-(2-methylpropyl)phenyl]ethanone;hydrochloride
CID 119491029
1-[(3S)-3-methylpiperidin-1-yl]-2-phenylethanone
CID 668860

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-1-(2-pyridin-4-ylacetyl)piperidin-3-yl]propanamide?
The IUPAC name of N-[(3R)-1-(2-pyridin-4-ylacetyl)piperidin-3-yl]propanamide (CID 95635726) is N-[(3R)-1-(2-pyridin-4-ylacetyl)piperidin-3-yl]propanamide.
What is the SMILES notation for N-[(3R)-1-(2-pyridin-4-ylacetyl)piperidin-3-yl]propanamide?
The canonical SMILES for N-[(3R)-1-(2-pyridin-4-ylacetyl)piperidin-3-yl]propanamide is CCC(=O)N[C@@H]1CCCN(C(=O)Cc2ccncc2)C1.
What is the InChIKey of N-[(3R)-1-(2-pyridin-4-ylacetyl)piperidin-3-yl]propanamide?
The InChIKey is HFLMJEUBHQNMIC-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-2-14(19)17-13-4-3-9-18(11-13)15(20)10-12-5-7-16-8-6-12/h5-8,13H,2-4,9-11H2,1H3,(H,17,19)/t13-/m1/s1.
What are the key properties of N-[(3R)-1-(2-pyridin-4-ylacetyl)piperidin-3-yl]propanamide?
N-[(3R)-1-(2-pyridin-4-ylacetyl)piperidin-3-yl]propanamide has a molecular weight of 275.35 g/mol, XLogP of 1.14, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-1-(2-pyridin-4-ylacetyl)piperidin-3-yl]propanamide is sourced from PubChem (CID 95635726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).