N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]naphthalene-2-carboxamide

C23H25N3O — CID 16895883

IUPACN-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]naphthalene-2-carboxamide
SMILESO=C(NCC1CCN(Cc2cccnc2)CC1)c1ccc2ccccc2c1
InChIInChI=1S/C23H25N3O/c27-23(22-8-7-20-5-1-2-6-21(20)14-22)25-16-18-9-12-26(13-10-18)17-19-4-3-11-24-15-19/h1-8,11,14-15,18H,9-10,12-13,16-17H2,(H,25,27)
InChIKeyCIYZRYPGXCHOKK-UHFFFAOYSA-N
MW359.47 g/mol
LogP3.88
Rot. Bonds5

About N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]naphthalene-2-carboxamide

N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]naphthalene-2-carboxamide (PubChem CID 16895883) has the molecular formula C23H25N3O and a molecular weight of 359.47 g/mol. Its IUPAC name is N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]naphthalene-2-carboxamide
PubChem CID16895883
Molecular FormulaC23H25N3O
Molecular Weight359.47 g/mol
Exact Mass359.20
IUPAC NameN-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]naphthalene-2-carboxamide
SMILESO=C(NCC1CCN(Cc2cccnc2)CC1)c1ccc2ccccc2c1
InChIInChI=1S/C23H25N3O/c27-23(22-8-7-20-5-1-2-6-21(20)14-22)25-16-18-9-12-26(13-10-18)17-19-4-3-11-24-15-19/h1-8,11,14-15,18H,9-10,12-13,16-17H2,(H,25,27)
InChIKeyCIYZRYPGXCHOKK-UHFFFAOYSA-N
XLogP3.88
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]benzamide
CID 16895865
3-methyl-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]benzamide
CID 16895892
2-(4-methoxyphenyl)-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]acetamide
CID 16895811
2,4,6-trimethyl-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]benzamide
CID 16895885
5-bromo-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]furan-2-carboxamide
CID 16895864
3-phenyl-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]propanamide
CID 16895855
N-[(1-benzylpiperidin-4-yl)methyl]-3-methoxybenzamide
CID 16895714
N-[[1-(2-phenylethyl)pyrrolidin-3-yl]methyl]naphthalene-2-carboxamide
CID 75369445
3-methoxy-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]benzamide
CID 16895960
5-chloro-2-nitro-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]benzamide
CID 16895834
3-methyl-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]benzamide
CID 16895986
4-N-phenyl-1-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]benzene-1,4-dicarboxamide
CID 167930415

Frequently Asked Questions

What is the IUPAC name of N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]naphthalene-2-carboxamide?
The IUPAC name of N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]naphthalene-2-carboxamide (CID 16895883) is N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]naphthalene-2-carboxamide.
What is the SMILES notation for N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]naphthalene-2-carboxamide?
The canonical SMILES for N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]naphthalene-2-carboxamide is O=C(NCC1CCN(Cc2cccnc2)CC1)c1ccc2ccccc2c1.
What is the InChIKey of N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]naphthalene-2-carboxamide?
The InChIKey is CIYZRYPGXCHOKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O/c27-23(22-8-7-20-5-1-2-6-21(20)14-22)25-16-18-9-12-26(13-10-18)17-19-4-3-11-24-15-19/h1-8,11,14-15,18H,9-10,12-13,16-17H2,(H,25,27).
What are the key properties of N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]naphthalene-2-carboxamide?
N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]naphthalene-2-carboxamide has a molecular weight of 359.47 g/mol, XLogP of 3.88, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]naphthalene-2-carboxamide is sourced from PubChem (CID 16895883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).