CID 70639140

C19H24N4OPSi — CID 70639140

IUPAC—
SMILESCCN1CCC(Nc2cccc(NC(=O)c3ccc(P)cc3[Si])n2)CC1
InChIInChI=1S/C19H24N4OPSi/c1-2-23-10-8-13(9-11-23)20-17-4-3-5-18(21-17)22-19(24)15-7-6-14(25)12-16(15)26/h3-7,12-13H,2,8-11,25H2,1H3,(H2,20,21,22,24)
InChIKeyWOPKXKRHTFZCHY-UHFFFAOYSA-N
MW383.49 g/mol
LogP1.52
Rot. Bonds5

About CID 70639140

CID 70639140 (PubChem CID 70639140) has the molecular formula C19H24N4OPSi and a molecular weight of 383.49 g/mol.

Molecular Properties

Compound NameCID 70639140
PubChem CID70639140
Molecular FormulaC19H24N4OPSi
Molecular Weight383.49 g/mol
Exact Mass383.15
IUPAC Name—
SMILESCCN1CCC(Nc2cccc(NC(=O)c3ccc(P)cc3[Si])n2)CC1
InChIInChI=1S/C19H24N4OPSi/c1-2-23-10-8-13(9-11-23)20-17-4-3-5-18(21-17)22-19(24)15-7-6-14(25)12-16(15)26/h3-7,12-13H,2,8-11,25H2,1H3,(H2,20,21,22,24)
InChIKeyWOPKXKRHTFZCHY-UHFFFAOYSA-N
XLogP1.52
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.49
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

2,3,4-trifluoro-N-[6-[(1-methylpiperidin-4-yl)amino]-2-pyridinyl]benzamide
CID 58997284
2-chloro-N-[6-[(1-ethylpiperidin-4-yl)methylamino]-2-pyridinyl]-4-fluorobenzamide;hydrochloride
CID 142780032
2,4,6-trifluoro-N-[6-[(1-methylpiperidin-4-yl)amino]-2-pyridinyl]benzamide;dihydrochloride
CID 66939247
N-(1-ethylpiperidin-4-yl)quinolin-2-amine
CID 60666937
6-hydrazinyl-N-(1-propylpiperidin-4-yl)pyridin-2-amine
CID 80897058
6-[(1-ethylpiperidin-4-yl)amino]-N-methylpyridazine-3-carboxamide
CID 79210349
2-[4-[(6-methyl-2-pyridinyl)amino]piperidin-1-yl]acetamide
CID 54895410
5-tert-butyl-N-(1-ethylpiperidin-4-yl)pyridin-2-amine
CID 107874539
2-[4-[(6-bromo-2-pyridinyl)amino]piperidin-1-yl]acetamide
CID 114156475
2-ethyl-4-[(1-ethylpiperidin-4-yl)amino]-1H-pyrimidin-6-one
CID 136974521
ethane;N-[6-(4-ethylpiperazine-1-carbonyl)-2-pyridinyl]-2,4,6-trifluorobenzamide
CID 178016546
2-chloro-5-[(1-ethylpiperidin-4-yl)amino]benzoic acid
CID 43736226

Frequently Asked Questions

What is the IUPAC name of CID 70639140?
The IUPAC name of CID 70639140 (CID 70639140) is not available.
What is the SMILES notation for CID 70639140?
The canonical SMILES for CID 70639140 is CCN1CCC(Nc2cccc(NC(=O)c3ccc(P)cc3[Si])n2)CC1.
What is the InChIKey of CID 70639140?
The InChIKey is WOPKXKRHTFZCHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4OPSi/c1-2-23-10-8-13(9-11-23)20-17-4-3-5-18(21-17)22-19(24)15-7-6-14(25)12-16(15)26/h3-7,12-13H,2,8-11,25H2,1H3,(H2,20,21,22,24).
What are the key properties of CID 70639140?
CID 70639140 has a molecular weight of 383.49 g/mol, XLogP of 1.52, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 70639140 is sourced from PubChem (CID 70639140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).