N-(1-benzylpiperidin-4-yl)-3-[2-(diethylamino)-4-pyridinyl]propanamide

C24H34N4O — CID 53186096

IUPACN-(1-benzylpiperidin-4-yl)-3-[2-(diethylamino)-4-pyridinyl]propanamide
SMILESCCN(CC)c1cc(CCC(=O)NC2CCN(Cc3ccccc3)CC2)ccn1
InChIInChI=1S/C24H34N4O/c1-3-28(4-2)23-18-20(12-15-25-23)10-11-24(29)26-22-13-16-27(17-14-22)19-21-8-6-5-7-9-21/h5-9,12,15,18,22H,3-4,10-11,13-14,16-17,19H2,1-2H3,(H,26,29)
InChIKeyRMLYTLGIETXLEE-UHFFFAOYSA-N
MW394.56 g/mol
LogP3.64
Rot. Bonds9

About N-(1-benzylpiperidin-4-yl)-3-[2-(diethylamino)-4-pyridinyl]propanamide

N-(1-benzylpiperidin-4-yl)-3-[2-(diethylamino)-4-pyridinyl]propanamide (PubChem CID 53186096) has the molecular formula C24H34N4O and a molecular weight of 394.56 g/mol. Its IUPAC name is N-(1-benzylpiperidin-4-yl)-3-[2-(diethylamino)-4-pyridinyl]propanamide.

Molecular Properties

Compound NameN-(1-benzylpiperidin-4-yl)-3-[2-(diethylamino)-4-pyridinyl]propanamide
PubChem CID53186096
Molecular FormulaC24H34N4O
Molecular Weight394.56 g/mol
Exact Mass394.27
IUPAC NameN-(1-benzylpiperidin-4-yl)-3-[2-(diethylamino)-4-pyridinyl]propanamide
SMILESCCN(CC)c1cc(CCC(=O)NC2CCN(Cc3ccccc3)CC2)ccn1
InChIInChI=1S/C24H34N4O/c1-3-28(4-2)23-18-20(12-15-25-23)10-11-24(29)26-22-13-16-27(17-14-22)19-21-8-6-5-7-9-21/h5-9,12,15,18,22H,3-4,10-11,13-14,16-17,19H2,1-2H3,(H,26,29)
InChIKeyRMLYTLGIETXLEE-UHFFFAOYSA-N
XLogP3.64
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.56
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-benzylpiperidin-4-yl)-3-(3-bromophenyl)propanamide
CID 127122392
N-benzyl-3-[2-(diethylamino)-4-pyridinyl]propanamide
CID 53186104
3-(3-methoxyphenyl)-N-[1-(pyridin-4-ylmethyl)piperidin-4-yl]propanamide
CID 91838188
3-[4-(dimethylamino)phenyl]-N-[1-(pyridin-4-ylmethyl)piperidin-4-yl]propanamide
CID 91791895
4-amino-N-(1-benzylpiperidin-4-yl)butanamide;dihydrochloride
CID 119827625
3-(1,3-benzoxazol-2-yl)-N-(1-benzylpiperidin-4-yl)propanamide
CID 39754999
3-[2-(diethylamino)-4-pyridinyl]-N-[2-(4-ethylpiperazin-1-yl)ethyl]propanamide
CID 53186190
N'-(1-benzylpiperidin-4-yl)butanediamide
CID 151114474
N-(1-benzylpiperidin-4-yl)-3-methyl-2-(3-phenylpropanoylamino)pentanamide
CID 42696307
N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-3-(4-ethylphenyl)propanamide
CID 55428414
N-(1-benzylpiperidin-4-yl)-3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide
CID 7420727
N-(1-benzylpiperidin-3-yl)-3-phenylpropanamide
CID 42958724

Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-4-yl)-3-[2-(diethylamino)-4-pyridinyl]propanamide?
The IUPAC name of N-(1-benzylpiperidin-4-yl)-3-[2-(diethylamino)-4-pyridinyl]propanamide (CID 53186096) is N-(1-benzylpiperidin-4-yl)-3-[2-(diethylamino)-4-pyridinyl]propanamide.
What is the SMILES notation for N-(1-benzylpiperidin-4-yl)-3-[2-(diethylamino)-4-pyridinyl]propanamide?
The canonical SMILES for N-(1-benzylpiperidin-4-yl)-3-[2-(diethylamino)-4-pyridinyl]propanamide is CCN(CC)c1cc(CCC(=O)NC2CCN(Cc3ccccc3)CC2)ccn1.
What is the InChIKey of N-(1-benzylpiperidin-4-yl)-3-[2-(diethylamino)-4-pyridinyl]propanamide?
The InChIKey is RMLYTLGIETXLEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H34N4O/c1-3-28(4-2)23-18-20(12-15-25-23)10-11-24(29)26-22-13-16-27(17-14-22)19-21-8-6-5-7-9-21/h5-9,12,15,18,22H,3-4,10-11,13-14,16-17,19H2,1-2H3,(H,26,29).
What are the key properties of N-(1-benzylpiperidin-4-yl)-3-[2-(diethylamino)-4-pyridinyl]propanamide?
N-(1-benzylpiperidin-4-yl)-3-[2-(diethylamino)-4-pyridinyl]propanamide has a molecular weight of 394.56 g/mol, XLogP of 3.64, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-4-yl)-3-[2-(diethylamino)-4-pyridinyl]propanamide is sourced from PubChem (CID 53186096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).