N-[(Z)-[1-methyl-4-[6-(piperidine-1-carbonyl)naphthalen-1-yl]-2-pyridinylidene]amino]formamide

C23H24N4O2 — CID 155042071

IUPACN-[(Z)-[1-methyl-4-[6-(piperidine-1-carbonyl)naphthalen-1-yl]-2-pyridinylidene]amino]formamide
SMILESCn1ccc(-c2cccc3cc(C(=O)N4CCCCC4)ccc23)c/c1=N/NC=O
InChIInChI=1S/C23H24N4O2/c1-26-13-10-18(15-22(26)25-24-16-28)20-7-5-6-17-14-19(8-9-21(17)20)23(29)27-11-3-2-4-12-27/h5-10,13-16H,2-4,11-12H2,1H3,(H,24,28)/b25-22-
InChIKeyVBHPALRAHAEPEV-LVWGJNHUSA-N
MW388.47 g/mol
LogP3.03
Rot. Bonds4

About N-[(Z)-[1-methyl-4-[6-(piperidine-1-carbonyl)naphthalen-1-yl]-2-pyridinylidene]amino]formamide

N-[(Z)-[1-methyl-4-[6-(piperidine-1-carbonyl)naphthalen-1-yl]-2-pyridinylidene]amino]formamide (PubChem CID 155042071) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is N-[(Z)-[1-methyl-4-[6-(piperidine-1-carbonyl)naphthalen-1-yl]-2-pyridinylidene]amino]formamide.

Molecular Properties

Compound NameN-[(Z)-[1-methyl-4-[6-(piperidine-1-carbonyl)naphthalen-1-yl]-2-pyridinylidene]amino]formamide
PubChem CID155042071
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC NameN-[(Z)-[1-methyl-4-[6-(piperidine-1-carbonyl)naphthalen-1-yl]-2-pyridinylidene]amino]formamide
SMILESCn1ccc(-c2cccc3cc(C(=O)N4CCCCC4)ccc23)c/c1=N/NC=O
InChIInChI=1S/C23H24N4O2/c1-26-13-10-18(15-22(26)25-24-16-28)20-7-5-6-17-14-19(8-9-21(17)20)23(29)27-11-3-2-4-12-27/h5-10,13-16H,2-4,11-12H2,1H3,(H,24,28)/b25-22-
InChIKeyVBHPALRAHAEPEV-LVWGJNHUSA-N
XLogP3.03
TPSA66.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[(dimethylamino)methyl]-4-[6-(3-fluoropiperidine-1-carbonyl)naphthalen-1-yl]benzaldehyde
CID 155042075
2-methyl-5-[6-[(3R)-3-methylpyrrolidine-1-carbonyl]naphthalen-1-yl]-3H-isoindol-1-one
CID 154667398
[2-(1-methylpyrrolo[2,3-b]pyridin-4-yl)-4-pyridinyl]-piperidin-1-ylmethanone
CID 70719790
azepan-1-yl-[3-(4-methylphenyl)phenyl]methanone
CID 126484488
7-[6-(4,4-difluoropiperidine-1-carbonyl)naphthalen-1-yl]-3-methylpyrido[3,2-d]pyrimidin-4-one
CID 154667377
2-methyl-8-[6-(piperidine-1-carbonyl)naphthalen-1-yl]-2,8-diazaspiro[4.5]decan-1-one
CID 154667269
(4-methyl-2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone
CID 146476155
5-[6-(4,4-difluoropiperidine-1-carbonyl)naphthalen-1-yl]-2-ethyl-3H-isoindol-1-one
CID 154667161
[5-(2-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl)naphthalen-2-yl]-piperidin-1-ylmethanone
CID 154667392
3-[6-(2-azaspiro[3.3]heptane-2-carbonyl)naphthalen-1-yl]-6-methyl-5H-pyrrolo[3,4-b]pyridin-7-one
CID 154667241
5-(1-methylpyrazol-3-yl)naphthalene-2-carboxylic acid
CID 90489761
azocan-1-yl-(3-methylphenyl)methanone
CID 3308040

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-[1-methyl-4-[6-(piperidine-1-carbonyl)naphthalen-1-yl]-2-pyridinylidene]amino]formamide?
The IUPAC name of N-[(Z)-[1-methyl-4-[6-(piperidine-1-carbonyl)naphthalen-1-yl]-2-pyridinylidene]amino]formamide (CID 155042071) is N-[(Z)-[1-methyl-4-[6-(piperidine-1-carbonyl)naphthalen-1-yl]-2-pyridinylidene]amino]formamide.
What is the SMILES notation for N-[(Z)-[1-methyl-4-[6-(piperidine-1-carbonyl)naphthalen-1-yl]-2-pyridinylidene]amino]formamide?
The canonical SMILES for N-[(Z)-[1-methyl-4-[6-(piperidine-1-carbonyl)naphthalen-1-yl]-2-pyridinylidene]amino]formamide is Cn1ccc(-c2cccc3cc(C(=O)N4CCCCC4)ccc23)c/c1=N/NC=O.
What is the InChIKey of N-[(Z)-[1-methyl-4-[6-(piperidine-1-carbonyl)naphthalen-1-yl]-2-pyridinylidene]amino]formamide?
The InChIKey is VBHPALRAHAEPEV-LVWGJNHUSA-N. The full InChI is InChI=1S/C23H24N4O2/c1-26-13-10-18(15-22(26)25-24-16-28)20-7-5-6-17-14-19(8-9-21(17)20)23(29)27-11-3-2-4-12-27/h5-10,13-16H,2-4,11-12H2,1H3,(H,24,28)/b25-22-.
What are the key properties of N-[(Z)-[1-methyl-4-[6-(piperidine-1-carbonyl)naphthalen-1-yl]-2-pyridinylidene]amino]formamide?
N-[(Z)-[1-methyl-4-[6-(piperidine-1-carbonyl)naphthalen-1-yl]-2-pyridinylidene]amino]formamide has a molecular weight of 388.47 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-[1-methyl-4-[6-(piperidine-1-carbonyl)naphthalen-1-yl]-2-pyridinylidene]amino]formamide is sourced from PubChem (CID 155042071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).