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

C24H26N2O — CID 108760742

IUPACN-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]naphthalene-1-carboxamide
SMILESCC1CCN(Cc2ccc(NC(=O)c3cccc4ccccc34)cc2)CC1
InChIInChI=1S/C24H26N2O/c1-18-13-15-26(16-14-18)17-19-9-11-21(12-10-19)25-24(27)23-8-4-6-20-5-2-3-7-22(20)23/h2-12,18H,13-17H2,1H3,(H,25,27)
InChIKeyOLLPXEZYJNXLRF-UHFFFAOYSA-N
MW358.49 g/mol
LogP5.32
Rot. Bonds4

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

N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]naphthalene-1-carboxamide (PubChem CID 108760742) has the molecular formula C24H26N2O and a molecular weight of 358.49 g/mol. Its IUPAC name is N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]naphthalene-1-carboxamide
PubChem CID108760742
Molecular FormulaC24H26N2O
Molecular Weight358.49 g/mol
Exact Mass358.20
IUPAC NameN-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]naphthalene-1-carboxamide
SMILESCC1CCN(Cc2ccc(NC(=O)c3cccc4ccccc34)cc2)CC1
InChIInChI=1S/C24H26N2O/c1-18-13-15-26(16-14-18)17-19-9-11-21(12-10-19)25-24(27)23-8-4-6-20-5-2-3-7-22(20)23/h2-12,18H,13-17H2,1H3,(H,25,27)
InChIKeyOLLPXEZYJNXLRF-UHFFFAOYSA-N
XLogP5.32
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.49
LogP ≤ 55.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]benzamide;dihydrochloride
CID 119946472
N-[4-(morpholin-4-ylmethyl)phenyl]naphthalene-1-carboxamide
CID 851463
4-[[4-[(4-methylpiperidin-1-yl)methyl]benzoyl]amino]benzoic acid
CID 46772046
4-chloro-N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]benzamide
CID 108760627
N-[[4-(piperidin-1-ylmethyl)phenyl]carbamothioyl]naphthalene-1-carboxamide
CID 3316137
N-(4-bromophenyl)-4-[(4-methylpiperidin-1-yl)methyl]benzamide
CID 43919557
5-amino-2-methyl-N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]benzamide;dihydrochloride
CID 120641536
N-[[4-(morpholin-4-ylmethyl)phenyl]carbamothioyl]naphthalene-1-carboxamide
CID 979219
2-(methylamino)-N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]acetamide
CID 120703837
N-[3-[4-[(4-methylpiperidin-1-yl)methyl]anilino]-3-oxopropyl]naphthalene-2-carboxamide
CID 55734289
N-[4-(4-ethylpiperazin-1-yl)phenyl]naphthalene-1-carboxamide
CID 7342466
N-(4-butylphenyl)-4-[(4-methylpiperidin-1-yl)methyl]benzamide
CID 30388448

Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]naphthalene-1-carboxamide?
The IUPAC name of N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]naphthalene-1-carboxamide (CID 108760742) is N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]naphthalene-1-carboxamide.
What is the SMILES notation for N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]naphthalene-1-carboxamide?
The canonical SMILES for N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]naphthalene-1-carboxamide is CC1CCN(Cc2ccc(NC(=O)c3cccc4ccccc34)cc2)CC1.
What is the InChIKey of N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]naphthalene-1-carboxamide?
The InChIKey is OLLPXEZYJNXLRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O/c1-18-13-15-26(16-14-18)17-19-9-11-21(12-10-19)25-24(27)23-8-4-6-20-5-2-3-7-22(20)23/h2-12,18H,13-17H2,1H3,(H,25,27).
What are the key properties of N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]naphthalene-1-carboxamide?
N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]naphthalene-1-carboxamide has a molecular weight of 358.49 g/mol, XLogP of 5.32, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]naphthalene-1-carboxamide is sourced from PubChem (CID 108760742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).