N-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]naphthalene-2-carboxamide

C23H24N2O — CID 40922093

IUPACN-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]naphthalene-2-carboxamide
SMILESC[C@H]1CCCCN1c1ccc(NC(=O)c2ccc3ccccc3c2)cc1
InChIInChI=1S/C23H24N2O/c1-17-6-4-5-15-25(17)22-13-11-21(12-14-22)24-23(26)20-10-9-18-7-2-3-8-19(18)16-20/h2-3,7-14,16-17H,4-6,15H2,1H3,(H,24,26)/t17-/m0/s1
InChIKeyYSXYZVXEGFLUGY-KRWDZBQOSA-N
MW344.46 g/mol
LogP5.47
Rot. Bonds3

About N-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]naphthalene-2-carboxamide

N-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]naphthalene-2-carboxamide (PubChem CID 40922093) has the molecular formula C23H24N2O and a molecular weight of 344.46 g/mol. Its IUPAC name is N-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]naphthalene-2-carboxamide
PubChem CID40922093
Molecular FormulaC23H24N2O
Molecular Weight344.46 g/mol
Exact Mass344.19
IUPAC NameN-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]naphthalene-2-carboxamide
SMILESC[C@H]1CCCCN1c1ccc(NC(=O)c2ccc3ccccc3c2)cc1
InChIInChI=1S/C23H24N2O/c1-17-6-4-5-15-25(17)22-13-11-21(12-14-22)24-23(26)20-10-9-18-7-2-3-8-19(18)16-20/h2-3,7-14,16-17H,4-6,15H2,1H3,(H,24,26)/t17-/m0/s1
InChIKeyYSXYZVXEGFLUGY-KRWDZBQOSA-N
XLogP5.47
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.46
LogP ≤ 55.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-dimethyl-N-[4-(2-methylpiperidin-1-yl)phenyl]benzamide
CID 17102832
N-[4-[(2R)-2-methylpiperidin-1-yl]phenyl]-4-propan-2-ylbenzamide
CID 26018303
3-methyl-N-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]-4-nitrobenzamide
CID 40922070
N-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide
CID 5120135
4-(2-methylpiperidin-1-yl)sulfonyl-N-naphthalen-2-ylbenzamide
CID 3267062
1-[4-(2-methylpiperidin-1-yl)phenyl]ethanone
CID 43176941
2-chloro-N-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]pyridine-3-carboxamide
CID 40922123
4-iodo-N-[[4-(2-methylpiperidin-1-yl)phenyl]carbamothioyl]benzamide
CID 17116461
N-[[4-[(2R)-2-methylpiperidin-1-yl]phenyl]carbamothioyl]-4-phenylmethoxybenzamide
CID 26019281
N-[3-[4-[(2-methylpiperidin-1-yl)methyl]anilino]-3-oxopropyl]naphthalene-2-carboxamide
CID 55736297
2-iodo-N-[[4-(2-methylpiperidin-1-yl)phenyl]carbamothioyl]benzamide
CID 17116463
N-(4-formylphenyl)naphthalene-2-carboxamide
CID 87842384

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]naphthalene-2-carboxamide?
The IUPAC name of N-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]naphthalene-2-carboxamide (CID 40922093) is N-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]naphthalene-2-carboxamide.
What is the SMILES notation for N-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]naphthalene-2-carboxamide?
The canonical SMILES for N-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]naphthalene-2-carboxamide is C[C@H]1CCCCN1c1ccc(NC(=O)c2ccc3ccccc3c2)cc1.
What is the InChIKey of N-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]naphthalene-2-carboxamide?
The InChIKey is YSXYZVXEGFLUGY-KRWDZBQOSA-N. The full InChI is InChI=1S/C23H24N2O/c1-17-6-4-5-15-25(17)22-13-11-21(12-14-22)24-23(26)20-10-9-18-7-2-3-8-19(18)16-20/h2-3,7-14,16-17H,4-6,15H2,1H3,(H,24,26)/t17-/m0/s1.
What are the key properties of N-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]naphthalene-2-carboxamide?
N-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]naphthalene-2-carboxamide has a molecular weight of 344.46 g/mol, XLogP of 5.47, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]naphthalene-2-carboxamide is sourced from PubChem (CID 40922093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).