N-[[(3R)-1-(furan-3-ylmethyl)piperidin-3-yl]methyl]-4-phenylbenzamide

C24H26N2O2 — CID 42195132

IUPACN-[[(3R)-1-(furan-3-ylmethyl)piperidin-3-yl]methyl]-4-phenylbenzamide
SMILESO=C(NC[C@H]1CCCN(Cc2ccoc2)C1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C24H26N2O2/c27-24(23-10-8-22(9-11-23)21-6-2-1-3-7-21)25-15-19-5-4-13-26(16-19)17-20-12-14-28-18-20/h1-3,6-12,14,18-19H,4-5,13,15-17H2,(H,25,27)/t19-/m1/s1
InChIKeySRDWQUPMKLKIEU-LJQANCHMSA-N
MW374.48 g/mol
LogP4.59
Rot. Bonds6

About N-[[(3R)-1-(furan-3-ylmethyl)piperidin-3-yl]methyl]-4-phenylbenzamide

N-[[(3R)-1-(furan-3-ylmethyl)piperidin-3-yl]methyl]-4-phenylbenzamide (PubChem CID 42195132) has the molecular formula C24H26N2O2 and a molecular weight of 374.48 g/mol. Its IUPAC name is N-[[(3R)-1-(furan-3-ylmethyl)piperidin-3-yl]methyl]-4-phenylbenzamide.

Molecular Properties

Compound NameN-[[(3R)-1-(furan-3-ylmethyl)piperidin-3-yl]methyl]-4-phenylbenzamide
PubChem CID42195132
Molecular FormulaC24H26N2O2
Molecular Weight374.48 g/mol
Exact Mass374.20
IUPAC NameN-[[(3R)-1-(furan-3-ylmethyl)piperidin-3-yl]methyl]-4-phenylbenzamide
SMILESO=C(NC[C@H]1CCCN(Cc2ccoc2)C1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C24H26N2O2/c27-24(23-10-8-22(9-11-23)21-6-2-1-3-7-21)25-15-19-5-4-13-26(16-19)17-20-12-14-28-18-20/h1-3,6-12,14,18-19H,4-5,13,15-17H2,(H,25,27)/t19-/m1/s1
InChIKeySRDWQUPMKLKIEU-LJQANCHMSA-N
XLogP4.59
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.48
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-[(2-aminopyrimidin-5-yl)methyl]piperidin-3-yl]methyl]-4-phenylbenzamide
CID 45243187
4-phenyl-N-[[(3R)-1-(pyrimidin-2-ylmethyl)piperidin-3-yl]methyl]benzamide
CID 97282396
4-phenyl-N-[[1-(pyrimidin-2-ylmethyl)piperidin-3-yl]methyl]benzamide
CID 72916739
N-[[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]methyl]-4-phenylbenzamide
CID 72891106
N-[[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]methyl]-4-phenylbenzamide
CID 45177344
N-[[(3S)-1-benzylpiperidin-3-yl]methyl]pyridine-4-carboxamide
CID 94779099
N-[[(3R)-1-benzylpiperidin-3-yl]methyl]-1-methyl-6-oxopyridine-3-carboxamide
CID 97314958
N-[[(3R)-1-benzylpiperidin-3-yl]methyl]-2-pyridin-3-ylpyrimidine-5-carboxamide
CID 97202083
N-[[1-(furan-3-ylmethyl)pyrrolidin-3-yl]methyl]-1-phenylcyclopropane-1-carboxamide
CID 56704001
N-[(1-benzylpiperidin-3-yl)methyl]acetamide
CID 10444612
4-fluoro-N-[[(3S)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methyl]benzamide
CID 25289047
N-[[1-(3-methylbut-2-enyl)piperidin-3-yl]methyl]furan-3-carboxamide
CID 131937285

Frequently Asked Questions

What is the IUPAC name of N-[[(3R)-1-(furan-3-ylmethyl)piperidin-3-yl]methyl]-4-phenylbenzamide?
The IUPAC name of N-[[(3R)-1-(furan-3-ylmethyl)piperidin-3-yl]methyl]-4-phenylbenzamide (CID 42195132) is N-[[(3R)-1-(furan-3-ylmethyl)piperidin-3-yl]methyl]-4-phenylbenzamide.
What is the SMILES notation for N-[[(3R)-1-(furan-3-ylmethyl)piperidin-3-yl]methyl]-4-phenylbenzamide?
The canonical SMILES for N-[[(3R)-1-(furan-3-ylmethyl)piperidin-3-yl]methyl]-4-phenylbenzamide is O=C(NC[C@H]1CCCN(Cc2ccoc2)C1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-[[(3R)-1-(furan-3-ylmethyl)piperidin-3-yl]methyl]-4-phenylbenzamide?
The InChIKey is SRDWQUPMKLKIEU-LJQANCHMSA-N. The full InChI is InChI=1S/C24H26N2O2/c27-24(23-10-8-22(9-11-23)21-6-2-1-3-7-21)25-15-19-5-4-13-26(16-19)17-20-12-14-28-18-20/h1-3,6-12,14,18-19H,4-5,13,15-17H2,(H,25,27)/t19-/m1/s1.
What are the key properties of N-[[(3R)-1-(furan-3-ylmethyl)piperidin-3-yl]methyl]-4-phenylbenzamide?
N-[[(3R)-1-(furan-3-ylmethyl)piperidin-3-yl]methyl]-4-phenylbenzamide has a molecular weight of 374.48 g/mol, XLogP of 4.59, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(3R)-1-(furan-3-ylmethyl)piperidin-3-yl]methyl]-4-phenylbenzamide is sourced from PubChem (CID 42195132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).