N-(1-benzylpiperidin-4-yl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide

C25H29N3O2 — CID 8756626

IUPACN-(1-benzylpiperidin-4-yl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide
SMILESO=C(CN[C@H](c1ccccc1)c1ccco1)NC1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C25H29N3O2/c29-24(18-26-25(23-12-7-17-30-23)21-10-5-2-6-11-21)27-22-13-15-28(16-14-22)19-20-8-3-1-4-9-20/h1-12,17,22,25-26H,13-16,18-19H2,(H,27,29)/t25-/m1/s1
InChIKeyWKUUUWFKLPCWEW-RUZDIDTESA-N
MW403.53 g/mol
LogP3.74
Rot. Bonds8

About N-(1-benzylpiperidin-4-yl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide

N-(1-benzylpiperidin-4-yl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide (PubChem CID 8756626) has the molecular formula C25H29N3O2 and a molecular weight of 403.53 g/mol. Its IUPAC name is N-(1-benzylpiperidin-4-yl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide.

Molecular Properties

Compound NameN-(1-benzylpiperidin-4-yl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide
PubChem CID8756626
Molecular FormulaC25H29N3O2
Molecular Weight403.53 g/mol
Exact Mass403.23
IUPAC NameN-(1-benzylpiperidin-4-yl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide
SMILESO=C(CN[C@H](c1ccccc1)c1ccco1)NC1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C25H29N3O2/c29-24(18-26-25(23-12-7-17-30-23)21-10-5-2-6-11-21)27-22-13-15-28(16-14-22)19-20-8-3-1-4-9-20/h1-12,17,22,25-26H,13-16,18-19H2,(H,27,29)/t25-/m1/s1
InChIKeyWKUUUWFKLPCWEW-RUZDIDTESA-N
XLogP3.74
TPSA57.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.53
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[(S)-furan-2-yl(phenyl)methyl]amino]-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
CID 8756584
N-(1-benzylpiperidin-4-yl)-2-[[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]amino]acetamide
CID 25495715
N-[(S)-furan-2-yl(phenyl)methyl]-1-(pyridin-3-ylmethyl)piperidin-4-amine
CID 97229376
N-[(R)-furan-2-yl(phenyl)methyl]-1-(pyridin-3-ylmethyl)piperidin-4-amine
CID 97229377
(2R)-N-(1-benzylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide
CID 118541642
2-[[(S)-furan-2-yl(phenyl)methyl]amino]-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
CID 8756580
N-[(3S)-1-benzylpyrrolidin-3-yl]-2-[[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]amino]acetamide
CID 8869172
N-(1-benzylpiperidin-4-yl)-2-[[(1S)-1-(3,4-difluorophenyl)ethyl]amino]acetamide
CID 8639280
2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 8755078
(2S)-N-(1-benzylpiperidin-4-yl)-2-methoxy-2-phenylacetamide
CID 118547816
N-(1-benzylpiperidin-4-yl)-2-methoxy-2-phenylacetamide
CID 123647467
N-(1-benzylpiperidin-4-yl)-2-(2-methylphenyl)sulfanylacetamide
CID 26691346

Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-4-yl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide?
The IUPAC name of N-(1-benzylpiperidin-4-yl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide (CID 8756626) is N-(1-benzylpiperidin-4-yl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide.
What is the SMILES notation for N-(1-benzylpiperidin-4-yl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide?
The canonical SMILES for N-(1-benzylpiperidin-4-yl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide is O=C(CN[C@H](c1ccccc1)c1ccco1)NC1CCN(Cc2ccccc2)CC1.
What is the InChIKey of N-(1-benzylpiperidin-4-yl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide?
The InChIKey is WKUUUWFKLPCWEW-RUZDIDTESA-N. The full InChI is InChI=1S/C25H29N3O2/c29-24(18-26-25(23-12-7-17-30-23)21-10-5-2-6-11-21)27-22-13-15-28(16-14-22)19-20-8-3-1-4-9-20/h1-12,17,22,25-26H,13-16,18-19H2,(H,27,29)/t25-/m1/s1.
What are the key properties of N-(1-benzylpiperidin-4-yl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide?
N-(1-benzylpiperidin-4-yl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide has a molecular weight of 403.53 g/mol, XLogP of 3.74, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-4-yl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide is sourced from PubChem (CID 8756626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).